---steric_par_bss---
started	18:27 05sec Wed 31 May 2006
HH H21-H6       HH H6-H6        HN H6-N61       HN H6-N8        HN H6-N9
HO H21-O7       HO H6-O6        HO H6-O7        NN N61-N61      NN N8-N8
NO N8-O6        NO N8-O7        OO O6-O6        OO O6-O7        OO O7-O7
from now this calulation will take 4929655473.09720 years

---steric_par_bss---
started	18:45 23sec Wed 31 May 2006
HH H21-H6       HH H6-H6        HN H6-N61       HN H6-N8        HN H6-N9
HO H21-O7       HO H6-O6        HO H6-O7
from now this calulation will take 17080.8918518519 days

---steric_par_bss---
started	15:32 02sec Thu 1 Jun 2006
Data assimilated. The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	
HO H21-O7	HO H6-O6	HO H6-O7
---steric_par_bss---
started	16:21 20sec Thu 1 Jun 2006
Data assimilated. The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	
HO H21-O7	HO H6-O6	HO H6-O7
finished	01:29 47sec Fri 2 Jun 2006
---steric_par_bss---
started	16:04 24sec Fri 2 Jun 2006
commencing parameterisation at 16:10 06sec Fri 2 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
---steric_par_bss---
started	16:53 37sec Fri 2 Jun 2006
commencing parameterisation at 16:59 13sec Fri 2 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	02:16 53sec Sat 3 Jun 2006
---steric_par_bss---
started	13:44 54sec Sat 3 Jun 2006
commencing parameterisation at 13:45 18sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	13:45 18sec Sat 3 Jun 2006
---steric_par_bss---
started	13:49 49sec Sat 3 Jun 2006
commencing parameterisation at 13:50 12sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	13:50 12sec Sat 3 Jun 2006
---steric_par_bss---
started	14:43 46sec Sat 3 Jun 2006
commencing parameterisation at 14:44 09sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	14:44 09sec Sat 3 Jun 2006
---steric_par_bss---
started	15:32 50sec Sat 3 Jun 2006
commencing parameterisation at 15:33 13sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
---steric_par_bss---
started	15:35 46sec Sat 3 Jun 2006
commencing parameterisation at 15:36 10sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
---steric_par_bss---
started	15:37 31sec Sat 3 Jun 2006
commencing parameterisation at 15:37 54sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
---steric_par_bss---
started	15:38 54sec Sat 3 Jun 2006
commencing parameterisation at 15:39 17sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
---steric_par_bss---
started	15:40 19sec Sat 3 Jun 2006
commencing parameterisation at 15:40 42sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
---steric_par_bss---
started	15:43 46sec Sat 3 Jun 2006
commencing parameterisation at 15:44 10sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
---steric_par_bss---
started	15:46 55sec Sat 3 Jun 2006
commencing parameterisation at 15:47 18sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	15:47 18sec Sat 3 Jun 2006
---steric_par_bss---
started	15:48 21sec Sat 3 Jun 2006
commencing parameterisation at 15:48 45sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	15:48 45sec Sat 3 Jun 2006
---steric_par_bss---
started	15:53 17sec Sat 3 Jun 2006
commencing parameterisation at 15:53 40sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	15:53 41sec Sat 3 Jun 2006
---steric_par_bss---
started	15:54 54sec Sat 3 Jun 2006
commencing parameterisation at 15:55 17sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	15:55 17sec Sat 3 Jun 2006
---steric_par_bss---
started	16:00 18sec Sat 3 Jun 2006
commencing parameterisation at 16:00 41sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	16:00 41sec Sat 3 Jun 2006
---steric_par_bss---
started	16:02 03sec Sat 3 Jun 2006
commencing parameterisation at 16:02 26sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	16:02 26sec Sat 3 Jun 2006
---steric_par_bss---
started	16:02 42sec Sat 3 Jun 2006
commencing parameterisation at 16:03 05sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	16:03 05sec Sat 3 Jun 2006
---steric_par_bss---
started	16:07 23sec Sat 3 Jun 2006
commencing parameterisation at 16:07 47sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	16:07 47sec Sat 3 Jun 2006
---steric_par_bss---
started	16:22 47sec Sat 3 Jun 2006
commencing parameterisation at 16:23 10sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	16:23 10sec Sat 3 Jun 2006
---steric_par_bss---
started	16:24 02sec Sat 3 Jun 2006
commencing parameterisation at 16:24 26sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	16:24 26sec Sat 3 Jun 2006
---steric_par_bss---
started	16:26 25sec Sat 3 Jun 2006
commencing parameterisation at 16:26 48sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	16:26 48sec Sat 3 Jun 2006
---steric_par_bss---
started	16:37 22sec Sat 3 Jun 2006
commencing parameterisation at 16:43 05sec Sat 3 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	01:28 55sec Sun 4 Jun 2006
---steric_par_bss---
started	22:19 49sec Sun 4 Jun 2006
commencing parameterisation at 22:24 58sec Sun 4 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	04:01 52sec Mon 5 Jun 2006
---steric_par_bss---
started	17:39 35sec Mon 5 Jun 2006
---steric_par_bss---
started	17:40 45sec Mon 5 Jun 2006
commencing parameterisation at 17:47 07sec Mon 5 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
2	6	12
---steric_par_bss---
started	17:51 32sec Mon 5 Jun 2006
commencing parameterisation at 17:56 41sec Mon 5 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
2	6	12
finished	18:50 00sec Mon 5 Jun 2006
---steric_par_bss---
started	14:57 26sec Tue 6 Jun 2006
commencing parameterisation at 15:02 42sec Tue 6 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
3	6	12
---steric_par_bss---
started	15:04 58sec Tue 6 Jun 2006
---steric_par_bss---
started	15:12 12sec Tue 6 Jun 2006
commencing parameterisation at 15:17 35sec Tue 6 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
3	6	12
---steric_par_bss---
started	15:22 22sec Tue 6 Jun 2006
commencing parameterisation at 15:28 02sec Tue 6 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	00:18 49sec Wed 7 Jun 2006
---steric_par_bss---
started	18:07 12sec Wed 7 Jun 2006
commencing parameterisation at 18:13 07sec Wed 7 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	02:55 36sec Thu 8 Jun 2006
---steric_par_bss---
started	14:38 36sec Thu 8 Jun 2006
---steric_par_bss---
started	14:40 53sec Thu 8 Jun 2006
commencing parameterisation at 14:46 37sec Thu 8 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
3	6	9	12
finished	14:46 39sec Thu 8 Jun 2006
---steric_par_bss---
started	15:46 56sec Thu 8 Jun 2006
---steric_par_bss---
started	15:47 46sec Thu 8 Jun 2006
commencing parameterisation at 15:53 58sec Thu 8 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
3	6	9	12
finished	15:54 01sec Thu 8 Jun 2006
---steric_par_bss---
started	16:25 15sec Thu 8 Jun 2006
commencing parameterisation at 16:30 59sec Thu 8 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	16:31 02sec Thu 8 Jun 2006
---steric_par_bss---
started	15:44 02sec Fri 9 Jun 2006
---steric_par_bss---
started	16:14 47sec Fri 9 Jun 2006
commencing parameterisation at 16:15 26sec Fri 9 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:15 26sec Fri 9 Jun 2006
---steric_par_bss---
started	16:19 32sec Fri 9 Jun 2006
commencing parameterisation at 16:20 10sec Fri 9 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:20 10sec Fri 9 Jun 2006
---steric_par_bss---
started	16:42 11sec Fri 9 Jun 2006
---steric_par_bss---
started	16:42 35sec Fri 9 Jun 2006
commencing parameterisation at 16:43 13sec Fri 9 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:43 13sec Fri 9 Jun 2006
---steric_par_bss---
started	16:46 46sec Fri 9 Jun 2006
commencing parameterisation at 16:52 05sec Fri 9 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	22:14 54sec Fri 9 Jun 2006
---steric_par_bss---
started	14:49 53sec Sat 10 Jun 2006
commencing parameterisation at 14:50 29sec Sat 10 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:54 48sec Sat 10 Jun 2006
commencing parameterisation at 14:55 24sec Sat 10 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	14:55 24sec Sat 10 Jun 2006
---steric_par_bss---
started	16:52 05sec Sat 10 Jun 2006
commencing parameterisation at 16:52 44sec Sat 10 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:52 44sec Sat 10 Jun 2006
---steric_par_bss---
started	16:58 42sec Sat 10 Jun 2006
commencing parameterisation at 17:04 30sec Sat 10 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	17:04 33sec Sat 10 Jun 2006
---steric_par_bss---
started	17:30 59sec Sat 10 Jun 2006
commencing parameterisation at 17:36 47sec Sat 10 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	22:51 06sec Sat 10 Jun 2006
---steric_par_bss---
started	13:58 09sec Sun 11 Jun 2006
commencing parameterisation at 13:59 28sec Sun 11 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	13:59 29sec Sun 11 Jun 2006
---steric_par_bss---
started	14:02 50sec Sun 11 Jun 2006
commencing parameterisation at 14:04 24sec Sun 11 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	14:04 24sec Sun 11 Jun 2006
---steric_par_bss---
started	14:07 40sec Sun 11 Jun 2006
commencing parameterisation at 14:09 07sec Sun 11 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	14:09 07sec Sun 11 Jun 2006
---steric_par_bss---
started	14:21 43sec Sun 11 Jun 2006
commencing parameterisation at 14:23 12sec Sun 11 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	14:23 12sec Sun 11 Jun 2006
---steric_par_bss---
started	14:36 48sec Sun 11 Jun 2006
---steric_par_bss---
started	14:37 30sec Sun 11 Jun 2006
commencing parameterisation at 14:38 56sec Sun 11 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	14:38 56sec Sun 11 Jun 2006
---steric_par_bss---
started	14:49 12sec Sun 11 Jun 2006
commencing parameterisation at 14:49 50sec Sun 11 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	14:49 50sec Sun 11 Jun 2006
---steric_par_bss---
started	14:51 13sec Sun 11 Jun 2006
commencing parameterisation at 14:51 51sec Sun 11 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	14:51 51sec Sun 11 Jun 2006
---steric_par_bss---
started	14:56 00sec Sun 11 Jun 2006
commencing parameterisation at 14:57 29sec Sun 11 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	14:57 29sec Sun 11 Jun 2006
---steric_par_bss---
started	14:59 55sec Sun 11 Jun 2006
commencing parameterisation at 15:01 24sec Sun 11 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
1	2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	15:01 24sec Sun 11 Jun 2006
---steric_par_bss---
started	15:09 52sec Sun 11 Jun 2006
---steric_par_bss---
started	15:10 43sec Sun 11 Jun 2006
commencing parameterisation at 15:15 49sec Sun 11 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	20:27 01sec Sun 11 Jun 2006
---steric_par_bss---
started	15:04 28sec Mon 12 Jun 2006
commencing parameterisation at 15:09 43sec Mon 12 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	20:22 49sec Mon 12 Jun 2006
---steric_par_bss---
started	17:07 52sec Tue 13 Jun 2006
commencing parameterisation at 17:13 18sec Tue 13 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	22:24 43sec Tue 13 Jun 2006
---steric_par_bss---
started	09:57 17sec Wed 14 Jun 2006
---steric_par_bss---
started	09:59 06sec Wed 14 Jun 2006
---steric_par_bss---
started	09:59 21sec Wed 14 Jun 2006
---steric_par_bss---
started	10:00 02sec Wed 14 Jun 2006
---steric_par_bss---
started	10:00 17sec Wed 14 Jun 2006
---steric_par_bss---
started	10:00 41sec Wed 14 Jun 2006
commencing parameterisation at 10:06 08sec Wed 14 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	10:06 11sec Wed 14 Jun 2006
---steric_par_bss---
started	12:14 59sec Wed 14 Jun 2006
commencing parameterisation at 12:20 01sec Wed 14 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	12:20 03sec Wed 14 Jun 2006
---steric_par_bss---
started	15:58 44sec Wed 14 Jun 2006
commencing parameterisation at 16:03 33sec Wed 14 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	19:28 39sec Wed 14 Jun 2006
---steric_par_bss---
started	12:38 48sec Thu 15 Jun 2006
commencing parameterisation at 12:39 26sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	12:42 14sec Thu 15 Jun 2006
commencing parameterisation at 12:42 50sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	12:42 50sec Thu 15 Jun 2006
---steric_par_bss---
started	12:57 43sec Thu 15 Jun 2006
commencing parameterisation at 12:58 20sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	12:58 20sec Thu 15 Jun 2006
---steric_par_bss---
started	13:05 49sec Thu 15 Jun 2006
commencing parameterisation at 13:06 28sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	13:06 28sec Thu 15 Jun 2006
---steric_par_bss---
started	13:09 08sec Thu 15 Jun 2006
commencing parameterisation at 13:09 48sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	13:09 48sec Thu 15 Jun 2006
---steric_par_bss---
started	13:13 56sec Thu 15 Jun 2006
commencing parameterisation at 13:14 37sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	13:14 37sec Thu 15 Jun 2006
---steric_par_bss---
started	13:16 09sec Thu 15 Jun 2006
commencing parameterisation at 13:16 48sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	13:16 49sec Thu 15 Jun 2006
---steric_par_bss---
started	13:20 12sec Thu 15 Jun 2006
commencing parameterisation at 13:20 50sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	13:20 50sec Thu 15 Jun 2006
---steric_par_bss---
started	13:22 20sec Thu 15 Jun 2006
commencing parameterisation at 13:22 57sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	13:22 57sec Thu 15 Jun 2006
---steric_par_bss---
started	13:37 03sec Thu 15 Jun 2006
commencing parameterisation at 13:37 40sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	13:37 40sec Thu 15 Jun 2006
---steric_par_bss---
started	13:47 17sec Thu 15 Jun 2006
commencing parameterisation at 13:47 54sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	13:47 54sec Thu 15 Jun 2006
---steric_par_bss---
started	14:00 45sec Thu 15 Jun 2006
commencing parameterisation at 14:01 22sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	14:01 22sec Thu 15 Jun 2006
---steric_par_bss---
started	14:04 39sec Thu 15 Jun 2006
commencing parameterisation at 14:05 16sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	14:05 16sec Thu 15 Jun 2006
---steric_par_bss---
started	14:11 29sec Thu 15 Jun 2006
commencing parameterisation at 14:12 04sec Thu 15 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	14:12 04sec Thu 15 Jun 2006
---steric_par_bss---
started	13:15 30sec Fri 16 Jun 2006
---steric_par_bss---
started	13:38 43sec Fri 16 Jun 2006
---steric_par_bss---
started	13:45 26sec Fri 16 Jun 2006
---steric_par_bss---
started	13:46 08sec Fri 16 Jun 2006
commencing parameterisation at 13:46 08sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	13:49 45sec Fri 16 Jun 2006
commencing parameterisation at 13:49 45sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	13:52 40sec Fri 16 Jun 2006
commencing parameterisation at 13:58 21sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:06 48sec Fri 16 Jun 2006
commencing parameterisation at 14:06 48sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:07 02sec Fri 16 Jun 2006
commencing parameterisation at 14:07 02sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:09 50sec Fri 16 Jun 2006
commencing parameterisation at 14:15 07sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:16 55sec Fri 16 Jun 2006
commencing parameterisation at 14:16 55sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:18 28sec Fri 16 Jun 2006
commencing parameterisation at 14:18 28sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:19 45sec Fri 16 Jun 2006
commencing parameterisation at 14:19 45sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:33 49sec Fri 16 Jun 2006
commencing parameterisation at 14:33 49sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:34 45sec Fri 16 Jun 2006
commencing parameterisation at 14:34 45sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:37 51sec Fri 16 Jun 2006
commencing parameterisation at 14:37 51sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:41 32sec Fri 16 Jun 2006
commencing parameterisation at 14:41 33sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:42 07sec Fri 16 Jun 2006
commencing parameterisation at 14:42 07sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	15:41 05sec Fri 16 Jun 2006
commencing parameterisation at 15:41 10sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:41 10sec Fri 16 Jun 2006
---steric_par_bss---
started	15:42 55sec Fri 16 Jun 2006
commencing parameterisation at 15:43 07sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:43 07sec Fri 16 Jun 2006
---steric_par_bss---
started	15:44 41sec Fri 16 Jun 2006
commencing parameterisation at 15:44 52sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:44 52sec Fri 16 Jun 2006
---steric_par_bss---
started	15:46 19sec Fri 16 Jun 2006
commencing parameterisation at 15:46 24sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:46 24sec Fri 16 Jun 2006
---steric_par_bss---
started	15:52 48sec Fri 16 Jun 2006
commencing parameterisation at 15:52 53sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:52 53sec Fri 16 Jun 2006
---steric_par_bss---
started	15:54 46sec Fri 16 Jun 2006
commencing parameterisation at 15:54 51sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:54 51sec Fri 16 Jun 2006
---steric_par_bss---
started	15:55 09sec Fri 16 Jun 2006
commencing parameterisation at 15:55 14sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:55 14sec Fri 16 Jun 2006
---steric_par_bss---
started	15:55 42sec Fri 16 Jun 2006
commencing parameterisation at 15:55 48sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:55 48sec Fri 16 Jun 2006
---steric_par_bss---
started	15:56 29sec Fri 16 Jun 2006
commencing parameterisation at 15:56 34sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:56 34sec Fri 16 Jun 2006
---steric_par_bss---
started	15:58 09sec Fri 16 Jun 2006
commencing parameterisation at 15:58 14sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:58 15sec Fri 16 Jun 2006
---steric_par_bss---
started	15:58 47sec Fri 16 Jun 2006
commencing parameterisation at 15:58 53sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:58 53sec Fri 16 Jun 2006
---steric_par_bss---
started	16:01 15sec Fri 16 Jun 2006
commencing parameterisation at 16:01 21sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:01 21sec Fri 16 Jun 2006
---steric_par_bss---
started	16:08 58sec Fri 16 Jun 2006
commencing parameterisation at 16:09 03sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:09 03sec Fri 16 Jun 2006
---steric_par_bss---
started	16:10 50sec Fri 16 Jun 2006
commencing parameterisation at 16:10 55sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:10 55sec Fri 16 Jun 2006
---steric_par_bss---
started	16:14 23sec Fri 16 Jun 2006
commencing parameterisation at 16:14 35sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:14 35sec Fri 16 Jun 2006
---steric_par_bss---
started	16:15 14sec Fri 16 Jun 2006
commencing parameterisation at 16:15 19sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:15 19sec Fri 16 Jun 2006
---steric_par_bss---
started	16:17 18sec Fri 16 Jun 2006
commencing parameterisation at 16:17 23sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:17 23sec Fri 16 Jun 2006
---steric_par_bss---
started	16:22 31sec Fri 16 Jun 2006
commencing parameterisation at 16:22 31sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	16:23 18sec Fri 16 Jun 2006
commencing parameterisation at 16:23 23sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:23 23sec Fri 16 Jun 2006
---steric_par_bss---
started	16:39 32sec Fri 16 Jun 2006
commencing parameterisation at 16:39 37sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:39 37sec Fri 16 Jun 2006
---steric_par_bss---
started	16:40 00sec Fri 16 Jun 2006
---steric_par_bss---
started	16:44 08sec Fri 16 Jun 2006
---steric_par_bss---
started	16:47 05sec Fri 16 Jun 2006
commencing parameterisation at 16:47 05sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	16:48 51sec Fri 16 Jun 2006
commencing parameterisation at 16:48 56sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:48 56sec Fri 16 Jun 2006
---steric_par_bss---
started	16:51 38sec Fri 16 Jun 2006
commencing parameterisation at 16:51 51sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:51 51sec Fri 16 Jun 2006
---steric_par_bss---
started	16:55 25sec Fri 16 Jun 2006
commencing parameterisation at 16:55 30sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:55 30sec Fri 16 Jun 2006
---steric_par_bss---
started	16:57 08sec Fri 16 Jun 2006
commencing parameterisation at 16:57 22sec Fri 16 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:57 22sec Fri 16 Jun 2006
---steric_par_bss---
started	21:47 45sec Sat 17 Jun 2006
finished	21:53 24sec Sat 17 Jun 2006
---steric_par_bss---
started	22:25 57sec Sat 17 Jun 2006
finished	22:31 11sec Sat 17 Jun 2006
---steric_par_bss---
started	22:37 16sec Sat 17 Jun 2006
finished	22:42 32sec Sat 17 Jun 2006
---steric_par_bss---
started	22:49 31sec Sat 17 Jun 2006
finished	22:54 43sec Sat 17 Jun 2006
---steric_par_bss---
started	22:59 37sec Sat 17 Jun 2006
commencing parameterisation at 23:05 14sec Sat 17 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	04:07 22sec Sun 18 Jun 2006
---steric_par_bss---
started	14:42 57sec Mon 19 Jun 2006
finished	14:43 33sec Mon 19 Jun 2006
---steric_par_bss---
started	14:59 08sec Mon 19 Jun 2006
finished	14:59 49sec Mon 19 Jun 2006
---steric_par_bss---
started	15:11 29sec Mon 19 Jun 2006
finished	15:12 02sec Mon 19 Jun 2006
---steric_par_bss---
started	16:50 40sec Wed 21 Jun 2006
commencing parameterisation at 16:50 41sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	16:52 27sec Wed 21 Jun 2006
commencing parameterisation at 16:52 27sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	16:58 23sec Wed 21 Jun 2006
commencing parameterisation at 16:58 23sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:00 42sec Wed 21 Jun 2006
commencing parameterisation at 17:00 44sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:02 34sec Wed 21 Jun 2006
commencing parameterisation at 17:02 34sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:04 31sec Wed 21 Jun 2006
commencing parameterisation at 17:04 32sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:06 39sec Wed 21 Jun 2006
commencing parameterisation at 17:06 40sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:07 30sec Wed 21 Jun 2006
commencing parameterisation at 17:07 31sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:08 21sec Wed 21 Jun 2006
commencing parameterisation at 17:08 21sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:09 46sec Wed 21 Jun 2006
commencing parameterisation at 17:09 46sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:10 18sec Wed 21 Jun 2006
commencing parameterisation at 17:10 18sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:10 50sec Wed 21 Jun 2006
commencing parameterisation at 17:10 51sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:11 31sec Wed 21 Jun 2006
commencing parameterisation at 17:11 31sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:11 52sec Wed 21 Jun 2006
commencing parameterisation at 17:11 53sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:12 43sec Wed 21 Jun 2006
commencing parameterisation at 17:12 44sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:13 54sec Wed 21 Jun 2006
commencing parameterisation at 17:13 54sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:14 12sec Wed 21 Jun 2006
commencing parameterisation at 17:14 13sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:16 36sec Wed 21 Jun 2006
commencing parameterisation at 17:16 36sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:18 14sec Wed 21 Jun 2006
commencing parameterisation at 17:18 15sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:22 15sec Wed 21 Jun 2006
commencing parameterisation at 17:22 17sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:22 47sec Wed 21 Jun 2006
commencing parameterisation at 17:22 49sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:23 43sec Wed 21 Jun 2006
commencing parameterisation at 17:23 46sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:24 09sec Wed 21 Jun 2006
commencing parameterisation at 17:24 11sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:25 28sec Wed 21 Jun 2006
commencing parameterisation at 17:25 31sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:26 26sec Wed 21 Jun 2006
commencing parameterisation at 17:26 29sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:26 55sec Wed 21 Jun 2006
commencing parameterisation at 17:26 57sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:27 01sec Wed 21 Jun 2006
commencing parameterisation at 17:27 03sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:30 39sec Wed 21 Jun 2006
commencing parameterisation at 17:30 41sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:40 07sec Wed 21 Jun 2006
commencing parameterisation at 17:40 10sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	17:40 24sec Wed 21 Jun 2006
commencing parameterisation at 17:40 27sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	17:40 29sec Wed 21 Jun 2006
---steric_par_bss---
started	18:44 38sec Wed 21 Jun 2006
commencing parameterisation at 18:44 41sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	18:44 43sec Wed 21 Jun 2006
---steric_par_bss---
started	18:45 01sec Wed 21 Jun 2006
commencing parameterisation at 18:45 04sec Wed 21 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	18:45 06sec Wed 21 Jun 2006
---steric_par_bss---
started	12:47 33sec Thu 22 Jun 2006
commencing parameterisation at 12:47 35sec Thu 22 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	12:47 37sec Thu 22 Jun 2006
---steric_par_bss---
started	12:48 21sec Thu 22 Jun 2006
commencing parameterisation at 12:48 24sec Thu 22 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	12:48 26sec Thu 22 Jun 2006
---steric_par_bss---
started	12:50 59sec Thu 22 Jun 2006
commencing parameterisation at 12:51 02sec Thu 22 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	12:51 03sec Thu 22 Jun 2006
---steric_par_bss---
started	15:45 55sec Thu 22 Jun 2006
commencing parameterisation at 15:46 36sec Thu 22 Jun 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	9	12
finished	15:46 36sec Thu 22 Jun 2006
---steric_par_bss---
started	15:47 27sec Thu 22 Jun 2006
commencing parameterisation at 15:52 51sec Thu 22 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	9	12
finished	15:52 53sec Thu 22 Jun 2006
---steric_par_bss---
started	16:10 18sec Thu 22 Jun 2006
commencing parameterisation at 16:10 20sec Thu 22 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	9	12
finished	16:10 26sec Thu 22 Jun 2006
---steric_par_bss---
started	16:11 40sec Thu 22 Jun 2006
commencing parameterisation at 16:11 42sec Thu 22 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	9	12
finished	16:11 47sec Thu 22 Jun 2006
---reg_mols 2---
started	14:42 30sec Fri 23 Jun 2006
commencing parameterisation in r.m. 2 at 14:42 32sec Fri 23 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	9	12
---reg_mols 2---
started	15:28 11sec Fri 23 Jun 2006
commencing parameterisation in r.m. 2 at 15:28 13sec Fri 23 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	9	12
---reg_mols 2---
started	15:28 40sec Fri 23 Jun 2006
commencing parameterisation in r.m. 2 at 15:28 43sec Fri 23 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	9	12
---reg_mols 2---
started	15:30 27sec Fri 23 Jun 2006
commencing parameterisation in r.m. 2 at 15:30 29sec Fri 23 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	9	12
---reg_mols 2---
started	15:30 46sec Fri 23 Jun 2006
commencing parameterisation in r.m. 2 at 15:30 49sec Fri 23 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	9	12
---steric_par_bss---
started	16:45 02sec Mon 26 Jun 2006
---steric_par_bss---
started	16:45 46sec Mon 26 Jun 2006
commencing parameterisation at 16:51 24sec Mon 26 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	16:51 26sec Mon 26 Jun 2006
---steric_par_bss---
started	17:59 08sec Mon 26 Jun 2006
commencing parameterisation at 17:59 10sec Mon 26 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	17:59 12sec Mon 26 Jun 2006
---steric_par_bss---
started	18:04 15sec Mon 26 Jun 2006
commencing parameterisation at 18:04 18sec Mon 26 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	18:04 30sec Mon 26 Jun 2006
commencing parameterisation at 18:04 32sec Mon 26 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	18:04 35sec Mon 26 Jun 2006
---steric_par_bss---
started	18:07 04sec Mon 26 Jun 2006
commencing parameterisation at 18:07 07sec Mon 26 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	18:07 09sec Mon 26 Jun 2006
---reg_mols 1---
started	17:15 43sec Tue 27 Jun 2006
commencing parameterisation in r.m. 1 at 17:15 45sec Tue 27 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	9	12
---reg_mols 1---
started	17:18 20sec Tue 27 Jun 2006
commencing parameterisation in r.m. 1 at 17:18 22sec Tue 27 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	9	12
---reg_mols 1---
started	17:21 16sec Tue 27 Jun 2006
commencing parameterisation in r.m. 1 at 17:21 19sec Tue 27 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---reg_mols 1---
started	17:22 08sec Tue 27 Jun 2006
commencing parameterisation in r.m. 1 at 17:22 11sec Tue 27 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---reg_mols 1---
started	17:24 00sec Tue 27 Jun 2006
commencing parameterisation in r.m. 1 at 17:24 03sec Tue 27 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---reg_mols 1---
started	17:28 39sec Tue 27 Jun 2006
commencing parameterisation in r.m. 1 at 17:28 42sec Tue 27 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	14:34 31sec Thu 29 Jun 2006
commencing parameterisation at 14:34 34sec Thu 29 Jun 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	14:34 36sec Thu 29 Jun 2006
---steric_par_bss---
started	16:02 52sec Tue 4 Jul 2006
---steric_par_bss---
started	16:57 32sec Wed 5 Jul 2006
commencing parameterisation at 16:57 34sec Wed 5 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	16:57 38sec Wed 5 Jul 2006
---reg_mols 1---
started	17:00 48sec Wed 5 Jul 2006
commencing parameterisation in r.m. 1 at 17:00 50sec Wed 5 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished r.m. 1	17:00 53sec Wed 5 Jul 2006
---reg_mols 1---
started	17:01 33sec Wed 5 Jul 2006
commencing parameterisation in r.m. 1 at 17:01 36sec Wed 5 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished r.m. 1	17:01 39sec Wed 5 Jul 2006
---reg_mols 1---
started	17:06 30sec Wed 5 Jul 2006
commencing parameterisation in r.m. 1 at 17:06 32sec Wed 5 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished r.m. 1	17:06 35sec Wed 5 Jul 2006
---reg_mols 1---
started	13:56 37sec Mon 24 Jul 2006
commencing parameterisation in r.m. 1 at 13:56 39sec Mon 24 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---reg_mols 1---
started	13:58 28sec Mon 24 Jul 2006
commencing parameterisation in r.m. 1 at 13:58 30sec Mon 24 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	16:55 58sec Tue 25 Jul 2006
commencing parameterisation at 16:56 10sec Tue 25 Jul 2006.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	OO O6-O6
The following hardness parameters are tested.
6	12
finished	16:56 10sec Tue 25 Jul 2006
---bss3-21G---
started	17:03 56sec Tue 25 Jul 2006
finished	17:04 12sec Tue 25 Jul 2006
---bss3-21G---
started	17:06 14sec Tue 25 Jul 2006
finished	17:06 17sec Tue 25 Jul 2006
---steric_par_bss---
started	17:35 29sec Tue 25 Jul 2006
commencing parameterisation at 17:40 54sec Tue 25 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	17:40 57sec Tue 25 Jul 2006
---steric_par_bss---
started	17:52 34sec Tue 25 Jul 2006
commencing parameterisation at 17:57 47sec Tue 25 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:50 44sec Tue 25 Jul 2006
---steric_par_bss---
started	16:09 14sec Fri 28 Jul 2006
commencing parameterisation at 16:14 47sec Fri 28 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	16:35 04sec Fri 28 Jul 2006
---reg_mols 1---
started	18:31 44sec Fri 28 Jul 2006
commencing parameterisation in r.m. 1 at 18:31 47sec Fri 28 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---reg_mols 1---
started	18:33 44sec Fri 28 Jul 2006
commencing parameterisation in r.m. 1 at 18:33 46sec Fri 28 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished r.m. 1	18:52 51sec Fri 28 Jul 2006
---reg_mols 1---
started	19:49 39sec Fri 28 Jul 2006
commencing parameterisation in r.m. 1 at 19:49 42sec Fri 28 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished r.m. 1	20:07 50sec Fri 28 Jul 2006
---reg_mols 1---
started	20:18 37sec Fri 28 Jul 2006
commencing parameterisation in r.m. 1 at 20:18 39sec Fri 28 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished r.m. 1	20:37 38sec Fri 28 Jul 2006
---reg_mols 1---
started	15:18 26sec Sat 29 Jul 2006
---reg_mols 1---
started	15:21 39sec Sat 29 Jul 2006
---reg_mols 1---
started	15:22 38sec Sat 29 Jul 2006
---reg_mols 1---
started	15:23 08sec Sat 29 Jul 2006
---reg_mols 1---
started	15:24 04sec Sat 29 Jul 2006
---reg_mols 1---
started	15:26 08sec Sat 29 Jul 2006
commencing parameterisation in r.m. 1 at 15:26 11sec Sat 29 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished r.m. 1	15:43 49sec Sat 29 Jul 2006
---reg_mols 1---
started	15:46 35sec Sat 29 Jul 2006
commencing parameterisation in r.m. 1 at 15:46 37sec Sat 29 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---reg_mols 1---
started	15:48 04sec Sat 29 Jul 2006
commencing parameterisation in r.m. 1 at 15:48 06sec Sat 29 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---reg_mols 1---
started	15:49 03sec Sat 29 Jul 2006
commencing parameterisation in r.m. 1 at 15:49 06sec Sat 29 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---reg_mols 1---
started	15:50 20sec Sat 29 Jul 2006
commencing parameterisation in r.m. 1 at 15:50 22sec Sat 29 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---reg_mols 1---
started	15:53 59sec Sat 29 Jul 2006
commencing parameterisation in r.m. 1 at 15:54 02sec Sat 29 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished r.m. 1	15:54 04sec Sat 29 Jul 2006
---reg_mols 1---
started	15:55 25sec Sat 29 Jul 2006
commencing parameterisation in r.m. 1 at 15:55 27sec Sat 29 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished r.m. 1	16:14 42sec Sat 29 Jul 2006
---reg_mols 1---
started	16:16 32sec Sat 29 Jul 2006
commencing parameterisation in r.m. 1 at 16:16 35sec Sat 29 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished r.m. 1	16:16 37sec Sat 29 Jul 2006
---reg_mols 1---
started	16:24 59sec Sat 29 Jul 2006
commencing parameterisation in r.m. 1 at 16:25 02sec Sat 29 Jul 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished r.m. 1	16:43 59sec Sat 29 Jul 2006
---steric_par_bss---
started	16:13 32sec Mon 31 Jul 2006
---steric_par_bss---
started	16:14 15sec Mon 31 Jul 2006
---steric_par_bss---
started	16:16 02sec Mon 31 Jul 2006
---steric_par_bss---
started	16:23 37sec Mon 31 Jul 2006
---steric_par_bss---
started	16:24 22sec Mon 31 Jul 2006
---steric_par_bss---
started	16:46 40sec Mon 31 Jul 2006
---steric_par_bss---
started	16:47 52sec Mon 31 Jul 2006
commencing parameterisation at 16:48 32sec Mon 31 Jul 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:48 32sec Mon 31 Jul 2006
---steric_par_bss---
started	18:00 46sec Mon 31 Jul 2006
commencing parameterisation at 18:00 55sec Mon 31 Jul 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	18:00 55sec Mon 31 Jul 2006
---steric_par_bss---
started	22:17 12sec Thu 3 Aug 2006
---steric_par_bss---
started	22:27 13sec Thu 3 Aug 2006
commencing parameterisation at 22:31 31sec Thu 3 Aug 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	22:55 16sec Thu 3 Aug 2006
commencing parameterisation at 22:59 59sec Thu 3 Aug 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:16 44sec Thu 3 Aug 2006
---steric_par_bss---
started	23:48 25sec Thu 3 Aug 2006
commencing parameterisation at 23:52 38sec Thu 3 Aug 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	00:09 28sec Fri 4 Aug 2006
---steric_par_bss---
started	00:42 03sec Fri 4 Aug 2006
commencing parameterisation at 00:46 21sec Fri 4 Aug 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	01:03 06sec Fri 4 Aug 2006
---steric_par_bss---
started	22:14 24sec Fri 4 Aug 2006
commencing parameterisation at 22:18 52sec Fri 4 Aug 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	22:35 50sec Fri 4 Aug 2006
---steric_par_bss---
started	00:37 24sec Sat 5 Aug 2006
commencing parameterisation at 00:41 35sec Sat 5 Aug 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	00:56 48sec Sat 5 Aug 2006
---steric_par_bss---
started	16:35 52sec Sun 6 Aug 2006
commencing parameterisation at 16:40 15sec Sun 6 Aug 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	16:55 37sec Sun 6 Aug 2006
---bss3-21G---
started	23:02 55sec Sun 6 Aug 2006
---bss3-21G---
started	23:11 50sec Sun 6 Aug 2006
finished	23:17 19sec Sun 6 Aug 2006
---bss3-21G---
started	23:41 03sec Sun 6 Aug 2006
finished	23:42 57sec Sun 6 Aug 2006
---steric_par_bss---
started	01:11 15sec Sat 12 Aug 2006
commencing parameterisation at 01:16 02sec Sat 12 Aug 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---bss3-21G---
started	18:29 17sec Sun 13 Aug 2006
finished	18:29 55sec Sun 13 Aug 2006
---steric_par_bss---
started	18:31 51sec Sun 13 Aug 2006
commencing parameterisation at 18:32 15sec Sun 13 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	18:32 15sec Sun 13 Aug 2006
---steric_par_bss---
started	18:34 08sec Sun 13 Aug 2006
commencing parameterisation at 18:34 32sec Sun 13 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
12
---steric_par_bss---
started	19:04 09sec Sun 13 Aug 2006
commencing parameterisation at 19:04 33sec Sun 13 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
12
finished	19:04 33sec Sun 13 Aug 2006
---steric_par_bss---
started	19:07 19sec Sun 13 Aug 2006
commencing parameterisation at 19:07 42sec Sun 13 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6
finished	19:07 42sec Sun 13 Aug 2006
---steric_par_bss---
started	19:11 28sec Sun 13 Aug 2006
commencing parameterisation at 19:12 08sec Sun 13 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	7	8	9	10	11	12	13	14	15	16
finished	19:12 08sec Sun 13 Aug 2006
---steric_par_bss---
started	23:41 41sec Sun 13 Aug 2006
commencing parameterisation at 23:41 50sec Sun 13 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	7	8	9	10	11	12	13	14	15	16
finished	23:41 50sec Sun 13 Aug 2006
---vdW_par_bss---
started	13:25 30sec Tue 15 Aug 2006
commencing parameterisation at 13:25 34sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	13:25 34sec Tue 15 Aug 2006
---vdW_par_bss---
started	13:40 19sec Tue 15 Aug 2006
commencing parameterisation at 13:40 22sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	13:40 22sec Tue 15 Aug 2006
---vdW_par_bss---
started	13:42 24sec Tue 15 Aug 2006
commencing parameterisation at 13:42 28sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	9	12	15
finished	13:42 28sec Tue 15 Aug 2006
---vdW_par_bss---
started	13:47 59sec Tue 15 Aug 2006
commencing parameterisation at 13:48 03sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	9	12	15
finished	13:48 03sec Tue 15 Aug 2006
---vdW_par_bss---
started	15:33 29sec Tue 15 Aug 2006
commencing parameterisation at 15:33 33sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	9	12	15
finished	15:33 33sec Tue 15 Aug 2006
---vdW_par_bss---
started	15:35 07sec Tue 15 Aug 2006
commencing parameterisation at 15:35 11sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	9	12	15
finished	15:35 11sec Tue 15 Aug 2006
---vdW_par_bss---
started	15:45 05sec Tue 15 Aug 2006
commencing parameterisation at 15:45 09sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:45 09sec Tue 15 Aug 2006
---vdW_par_bss---
started	15:47 17sec Tue 15 Aug 2006
commencing parameterisation at 15:47 21sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:47 21sec Tue 15 Aug 2006
---vdW_par_bss---
started	15:49 34sec Tue 15 Aug 2006
commencing parameterisation at 15:49 37sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:49 37sec Tue 15 Aug 2006
---vdW_par_bss---
started	15:54 22sec Tue 15 Aug 2006
commencing parameterisation at 15:54 26sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:54 26sec Tue 15 Aug 2006
---steric_par_bss---
started	16:13 52sec Tue 15 Aug 2006
commencing parameterisation at 16:13 57sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	7	8	9	10	11	12	13	14	15	16
finished	16:13 57sec Tue 15 Aug 2006
---vdW_par_bss---
started	16:34 24sec Tue 15 Aug 2006
commencing parameterisation at 16:34 28sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:34 28sec Tue 15 Aug 2006
---vdW_par_bss---
started	16:36 02sec Tue 15 Aug 2006
commencing parameterisation at 16:36 06sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:36 06sec Tue 15 Aug 2006
---vdW_par_bss---
started	16:36 40sec Tue 15 Aug 2006
commencing parameterisation at 16:36 44sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:36 44sec Tue 15 Aug 2006
---vdW_par_bss---
started	16:37 23sec Tue 15 Aug 2006
commencing parameterisation at 16:37 26sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:37 26sec Tue 15 Aug 2006
---vdW_par_bss---
started	16:53 05sec Tue 15 Aug 2006
commencing parameterisation at 16:53 09sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:53 09sec Tue 15 Aug 2006
---vdW_par_bss---
started	16:55 00sec Tue 15 Aug 2006
commencing parameterisation at 16:55 03sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:55 03sec Tue 15 Aug 2006
---steric_par_bss---
started	16:58 23sec Tue 15 Aug 2006
commencing parameterisation at 16:58 38sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	7	8	9	10	11	12	13	14	15	16
finished	16:58 38sec Tue 15 Aug 2006
---vdW_par_bss---
started	17:07 23sec Tue 15 Aug 2006
commencing parameterisation at 17:07 27sec Tue 15 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	9	12	15
finished	17:07 27sec Tue 15 Aug 2006
---bss3-21G---
started	23:26 44sec Wed 16 Aug 2006
finished	23:26 45sec Wed 16 Aug 2006
---bss3-21G---
started	23:28 07sec Wed 16 Aug 2006
finished	23:30 07sec Wed 16 Aug 2006
---bss3-21G---
started	23:56 52sec Wed 16 Aug 2006
finished	23:58 52sec Wed 16 Aug 2006
---steric_par_bss---
started	00:03 44sec Thu 17 Aug 2006
commencing parameterisation at 00:07 54sec Thu 17 Aug 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	00:32 22sec Thu 17 Aug 2006
---vdW_par_bss---
started	11:27 17sec Thu 17 Aug 2006
commencing parameterisation at 11:27 26sec Thu 17 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	11:27 26sec Thu 17 Aug 2006
---steric_par_bss---
started	11:40 21sec Thu 17 Aug 2006
commencing parameterisation at 11:40 43sec Thu 17 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	11:40 43sec Thu 17 Aug 2006
---steric_par_bss---
started	11:56 34sec Thu 17 Aug 2006
commencing parameterisation at 11:56 43sec Thu 17 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	11:56 43sec Thu 17 Aug 2006
---vdW_par_bss---
started	12:01 46sec Thu 17 Aug 2006
commencing parameterisation at 12:02 48sec Thu 17 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	12:02 48sec Thu 17 Aug 2006
---steric_par_bss---
started	22:29 23sec Wed 23 Aug 2006
commencing parameterisation at 22:30 32sec Wed 23 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	22:30 33sec Wed 23 Aug 2006
---steric_par_bss---
started	22:34 11sec Wed 23 Aug 2006
commencing parameterisation at 22:34 19sec Wed 23 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	22:34 19sec Wed 23 Aug 2006
---steric_par_bss---
started	22:52 24sec Mon 28 Aug 2006
commencing parameterisation at 22:52 33sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	22:52 33sec Mon 28 Aug 2006
---steric_par_bss---
started	22:59 00sec Mon 28 Aug 2006
commencing parameterisation at 22:59 07sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	9	12	15
finished	22:59 07sec Mon 28 Aug 2006
---vdW_par_bss---
started	23:02 31sec Mon 28 Aug 2006
commencing parameterisation at 23:02 42sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	23:02 42sec Mon 28 Aug 2006
---vdW_par_bss---
started	23:09 29sec Mon 28 Aug 2006
commencing parameterisation at 23:09 34sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	9	12	15
---vdW_par_bss---
started	23:09 40sec Mon 28 Aug 2006
commencing parameterisation at 23:09 44sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	9	12	15
finished	23:09 44sec Mon 28 Aug 2006
---vdW_par_bss---
started	23:26 20sec Mon 28 Aug 2006
commencing parameterisation at 23:26 25sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	9	12	15
finished	23:26 25sec Mon 28 Aug 2006
---vdW_par_bss---
started	23:30 07sec Mon 28 Aug 2006
commencing parameterisation at 23:30 16sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	23:30 16sec Mon 28 Aug 2006
---steric_par_bss---
started	23:33 26sec Mon 28 Aug 2006
commencing parameterisation at 23:33 31sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	9	12	15
finished	23:33 31sec Mon 28 Aug 2006
---steric_par_bss---
started	23:39 37sec Mon 28 Aug 2006
commencing parameterisation at 23:39 46sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	23:39 46sec Mon 28 Aug 2006
---vdW_par_bss---
started	23:44 14sec Mon 28 Aug 2006
commencing parameterisation at 23:44 22sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	23:44 22sec Mon 28 Aug 2006
---steric_par_bss---
started	23:50 22sec Mon 28 Aug 2006
commencing parameterisation at 23:50 30sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	23:50 30sec Mon 28 Aug 2006
---vdW_par_bss---
started	23:52 48sec Mon 28 Aug 2006
commencing parameterisation at 23:52 57sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	23:52 57sec Mon 28 Aug 2006
---steric_par_bss---
started	23:54 53sec Mon 28 Aug 2006
commencing parameterisation at 23:55 01sec Mon 28 Aug 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	23:55 01sec Mon 28 Aug 2006
---steric_par_bss---
started	22:40 10sec Fri 22 Sep 2006
finished	22:44 23sec Fri 22 Sep 2006
---vdW_par_bss---
started	14:47 23sec Sat 23 Sep 2006
commencing parameterisation at 14:51 43sec Sat 23 Sep 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	14:51 47sec Sat 23 Sep 2006
---bss3-21G---
started	22:57 12sec Mon 25 Sep 2006
---bss3-21G---
started	23:00 02sec Mon 25 Sep 2006
---bss3-21G---
started	23:01 02sec Mon 25 Sep 2006
---bss3-21G---
started	23:01 39sec Mon 25 Sep 2006
finished	23:01 44sec Mon 25 Sep 2006
---bss3-21G---
started	00:13 41sec Tue 26 Sep 2006
finished	00:13 46sec Tue 26 Sep 2006
---bss3-21G---
started	00:15 59sec Tue 26 Sep 2006
finished	00:16 04sec Tue 26 Sep 2006
---bss3-21G---
started	00:18 46sec Tue 26 Sep 2006
finished	00:18 51sec Tue 26 Sep 2006
---bss3-21G---
started	00:20 20sec Tue 26 Sep 2006
finished	00:20 26sec Tue 26 Sep 2006
---bss3-21G---
started	00:23 47sec Tue 26 Sep 2006
---bss3-21G---
started	00:25 57sec Tue 26 Sep 2006
---bss3-21G---
started	00:28 03sec Tue 26 Sep 2006
finished	00:28 08sec Tue 26 Sep 2006
---bss3-21G---
started	00:32 29sec Tue 26 Sep 2006
finished	00:32 34sec Tue 26 Sep 2006
---bss3-21G---
started	00:40 24sec Tue 26 Sep 2006
finished	00:40 29sec Tue 26 Sep 2006
---bss3-21G---
started	00:43 16sec Tue 26 Sep 2006
finished	00:43 27sec Tue 26 Sep 2006
---bss3-21G---
started	21:27 51sec Tue 26 Sep 2006
finished	21:27 57sec Tue 26 Sep 2006
---bss3-21G---
started	21:52 35sec Tue 26 Sep 2006
finished	21:52 40sec Tue 26 Sep 2006
---bss3-21G---
started	21:56 24sec Tue 26 Sep 2006
finished	21:56 30sec Tue 26 Sep 2006
---bss3-21G---
started	21:57 57sec Tue 26 Sep 2006
finished	21:58 02sec Tue 26 Sep 2006
---bss3-21G---
started	21:58 59sec Tue 26 Sep 2006
finished	21:59 04sec Tue 26 Sep 2006
---bss3-21G---
started	22:06 33sec Tue 26 Sep 2006
finished	22:06 38sec Tue 26 Sep 2006
---vdW_par_bss---
started	21:03 30sec Mon 2 Oct 2006
commencing parameterisation at 21:03 41sec Mon 2 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
2	3	4	5	6
finished	21:03 55sec Mon 2 Oct 2006
---vdW_par_bss---
started	21:34 08sec Mon 2 Oct 2006
commencing parameterisation at 21:34 18sec Mon 2 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
2	3	4	5	6
finished	21:34 20sec Mon 2 Oct 2006
---vdW_par_bss---
started	22:49 25sec Mon 2 Oct 2006
commencing parameterisation at 22:49 34sec Mon 2 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
2	3	4	5	6
finished	22:49 41sec Mon 2 Oct 2006
---vdW_par_bss---
started	22:53 34sec Mon 2 Oct 2006
commencing parameterisation at 22:53 43sec Mon 2 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
2	3	4	5	6
finished	22:53 50sec Mon 2 Oct 2006
---vdW_par_bss---
started	23:09 10sec Mon 2 Oct 2006
commencing parameterisation at 23:09 20sec Mon 2 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
2	3	4	5	6
finished	23:09 27sec Mon 2 Oct 2006
---vdW_par_bss---
started	17:45 40sec Tue 3 Oct 2006
commencing parameterisation at 17:45 51sec Tue 3 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
2	3	4	5	6
finished	17:45 58sec Tue 3 Oct 2006
---vdW_par_bss---
started	17:49 27sec Tue 3 Oct 2006
commencing parameterisation at 17:49 36sec Tue 3 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
2	3	4	5	6
finished	17:49 39sec Tue 3 Oct 2006
---vdW_par_bss---
started	22:41 02sec Tue 3 Oct 2006
---vdW_par_bss---
started	22:41 39sec Tue 3 Oct 2006
commencing parameterisation at 22:43 15sec Tue 3 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N8
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12
finished	00:00 19sec Wed 4 Oct 2006
---vdW_par_bss---
started	10:39 05sec Wed 4 Oct 2006
commencing parameterisation at 10:41 00sec Wed 4 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N8
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12
finished	11:58 11sec Wed 4 Oct 2006
---bss3-21G---
started	21:49 41sec Wed 4 Oct 2006
---bss3-21G---
started	21:53 49sec Wed 4 Oct 2006
finished	21:53 54sec Wed 4 Oct 2006
---bss3-21G---
started	12:18 21sec Thu 5 Oct 2006
finished	12:18 22sec Thu 5 Oct 2006
---bss3-21G---
started	13:05 56sec Thu 5 Oct 2006
finished	13:05 56sec Thu 5 Oct 2006
---bss3-21G---
started	13:07 14sec Thu 5 Oct 2006
finished	13:07 14sec Thu 5 Oct 2006
---bss3-21G---
started	13:07 32sec Thu 5 Oct 2006
finished	13:07 33sec Thu 5 Oct 2006
---bss3-21G---
started	16:03 56sec Thu 5 Oct 2006
finished	16:03 56sec Thu 5 Oct 2006
---bss3-21G---
started	16:13 07sec Thu 5 Oct 2006
finished	16:13 08sec Thu 5 Oct 2006
---bss3-21G---
started	16:16 12sec Thu 5 Oct 2006
finished	16:16 12sec Thu 5 Oct 2006
---bss3-21G---
started	16:36 00sec Thu 5 Oct 2006
finished	16:36 01sec Thu 5 Oct 2006
---bss3-21G---
started	16:39 05sec Thu 5 Oct 2006
finished	16:39 05sec Thu 5 Oct 2006
---bss3-21G---
started	16:45 30sec Thu 5 Oct 2006
finished	16:45 30sec Thu 5 Oct 2006
---bss3-21G---
started	23:08 56sec Thu 5 Oct 2006
finished	23:08 57sec Thu 5 Oct 2006
---bss3-21G---
started	23:10 46sec Thu 5 Oct 2006
finished	23:10 46sec Thu 5 Oct 2006
---bss3-21G---
started	23:13 28sec Thu 5 Oct 2006
---bss3-21G---
started	23:15 06sec Thu 5 Oct 2006
finished	23:15 06sec Thu 5 Oct 2006
---bss3-21G---
started	23:16 37sec Thu 5 Oct 2006
finished	23:16 37sec Thu 5 Oct 2006
---bss3-21G---
started	23:19 59sec Thu 5 Oct 2006
finished	23:20 00sec Thu 5 Oct 2006
---bss3-21G---
started	23:25 01sec Thu 5 Oct 2006
finished	23:25 02sec Thu 5 Oct 2006
---bss3-21G---
started	23:25 42sec Thu 5 Oct 2006
finished	23:25 43sec Thu 5 Oct 2006
---bss3-21G---
started	23:29 46sec Thu 5 Oct 2006
finished	23:29 46sec Thu 5 Oct 2006
---bss3-21G---
started	23:31 02sec Thu 5 Oct 2006
finished	23:31 02sec Thu 5 Oct 2006
---bss3-21G---
started	23:32 49sec Thu 5 Oct 2006
finished	23:32 49sec Thu 5 Oct 2006
---bss3-21G---
started	10:27 15sec Sat 7 Oct 2006
finished	10:27 16sec Sat 7 Oct 2006
---bss3-21G---
started	10:31 28sec Sat 7 Oct 2006
finished	10:31 29sec Sat 7 Oct 2006
---bss3-21G---
started	11:19 36sec Sat 7 Oct 2006
finished	11:19 36sec Sat 7 Oct 2006
---bss3-21G---
started	11:21 24sec Sat 7 Oct 2006
finished	11:21 24sec Sat 7 Oct 2006
---bss3-21G---
started	11:22 35sec Sat 7 Oct 2006
finished	11:22 36sec Sat 7 Oct 2006
---bss3-21G---
started	11:29 06sec Sat 7 Oct 2006
finished	11:29 07sec Sat 7 Oct 2006
---bss3-21G---
started	11:57 39sec Sat 7 Oct 2006
finished	11:57 39sec Sat 7 Oct 2006
---bss3-21G---
started	11:58 56sec Sat 7 Oct 2006
finished	11:58 57sec Sat 7 Oct 2006
---bss3-21G---
started	12:08 08sec Sat 7 Oct 2006
finished	12:08 09sec Sat 7 Oct 2006
---bss3-21G---
started	12:54 40sec Sat 7 Oct 2006
---bss3-21G---
started	12:56 35sec Sat 7 Oct 2006
---bss3-21G---
started	12:58 15sec Sat 7 Oct 2006
finished	12:58 15sec Sat 7 Oct 2006
---bss3-21G---
started	13:01 58sec Sat 7 Oct 2006
---bss3-21G---
started	13:08 38sec Sat 7 Oct 2006
---bss3-21G---
started	13:12 48sec Sat 7 Oct 2006
---bss3-21G---
started	14:00 52sec Sat 7 Oct 2006
---bss3-21G---
started	14:02 22sec Sat 7 Oct 2006
---bss3-21G---
started	14:04 11sec Sat 7 Oct 2006
---bss3-21G---
started	14:04 27sec Sat 7 Oct 2006
---bss3-21G---
started	14:05 04sec Sat 7 Oct 2006
---bss3-21G---
started	14:06 13sec Sat 7 Oct 2006
---bss3-21G---
started	14:07 55sec Sat 7 Oct 2006
finished	14:07 55sec Sat 7 Oct 2006
---bss3-21G---
started	14:09 17sec Sat 7 Oct 2006
finished	14:09 18sec Sat 7 Oct 2006
---bss3-21G---
started	14:12 38sec Sat 7 Oct 2006
finished	14:12 39sec Sat 7 Oct 2006
---bss3-21G---
started	14:13 12sec Sat 7 Oct 2006
finished	14:13 12sec Sat 7 Oct 2006
---bss3-21G---
started	14:15 12sec Sat 7 Oct 2006
finished	14:15 12sec Sat 7 Oct 2006
---bss3-21G---
started	14:16 35sec Sat 7 Oct 2006
finished	14:16 36sec Sat 7 Oct 2006
---bss3-21G---
started	14:17 34sec Sat 7 Oct 2006
finished	14:17 34sec Sat 7 Oct 2006
---bss3-21G---
started	14:24 55sec Sat 7 Oct 2006
finished	14:24 55sec Sat 7 Oct 2006
---bss3-21G---
started	14:28 22sec Sat 7 Oct 2006
finished	14:28 22sec Sat 7 Oct 2006
---bss3-21G---
started	14:29 03sec Sat 7 Oct 2006
finished	14:29 03sec Sat 7 Oct 2006
---bss3-21G---
started	14:43 50sec Sat 7 Oct 2006
finished	14:43 50sec Sat 7 Oct 2006
---bss3-21G---
started	14:46 44sec Sat 7 Oct 2006
finished	14:46 44sec Sat 7 Oct 2006
---bss3-21G---
started	14:47 52sec Sat 7 Oct 2006
finished	14:47 52sec Sat 7 Oct 2006
---bss3-21G---
started	14:48 32sec Sat 7 Oct 2006
finished	14:48 32sec Sat 7 Oct 2006
---bss3-21G---
started	14:54 20sec Sat 7 Oct 2006
finished	14:54 20sec Sat 7 Oct 2006
---bss3-21G---
started	15:05 24sec Sat 7 Oct 2006
finished	15:05 24sec Sat 7 Oct 2006
---bss3-21G---
started	15:13 49sec Sat 7 Oct 2006
finished	15:13 49sec Sat 7 Oct 2006
---bss3-21G---
started	15:19 04sec Sat 7 Oct 2006
finished	15:19 04sec Sat 7 Oct 2006
---bss3-21G---
started	15:27 11sec Sat 7 Oct 2006
finished	15:27 11sec Sat 7 Oct 2006
---bss3-21G---
started	15:33 46sec Sat 7 Oct 2006
finished	15:33 47sec Sat 7 Oct 2006
---bss3-21G---
started	15:34 06sec Sat 7 Oct 2006
finished	15:34 07sec Sat 7 Oct 2006
---bss3-21G---
started	15:35 08sec Sat 7 Oct 2006
finished	15:35 08sec Sat 7 Oct 2006
---bss3-21G---
started	15:37 52sec Sat 7 Oct 2006
finished	15:37 52sec Sat 7 Oct 2006
---bss3-21G---
started	15:39 08sec Sat 7 Oct 2006
finished	15:39 08sec Sat 7 Oct 2006
---bss3-21G---
started	15:39 59sec Sat 7 Oct 2006
finished	15:39 59sec Sat 7 Oct 2006
---vdW_par_bss---
started	17:06 00sec Sat 7 Oct 2006
commencing parameterisation at 17:08 05sec Sat 7 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12
finished	18:31 40sec Sat 7 Oct 2006
---vdW_par_bss---
started	18:40 31sec Sat 7 Oct 2006
commencing parameterisation at 18:42 27sec Sat 7 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	19:33 17sec Sat 7 Oct 2006
---vdW_par_bss---
started	22:20 13sec Sat 7 Oct 2006
---vdW_par_bss---
started	22:21 01sec Sat 7 Oct 2006
---vdW_par_bss---
started	22:22 48sec Sat 7 Oct 2006
commencing parameterisation at 22:25 25sec Sat 7 Oct 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	23:16 21sec Sat 7 Oct 2006
---steric_par_bss---
started	00:31 38sec Sun 8 Oct 2006
finished	00:33 37sec Sun 8 Oct 2006
---par_bss---
started	17:51 01sec Sun 8 Oct 2006
---par_bss---
started	17:56 44sec Sun 8 Oct 2006
---par_bss---
started	18:46 51sec Sun 8 Oct 2006
---par_bss---
started	18:47 29sec Sun 8 Oct 2006
---par_bss---
started	18:49 49sec Sun 8 Oct 2006
finished	20:16 23sec Sun 8 Oct 2006
---vdW_par_bss---
started	22:29 57sec Fri 3 Nov 2006
commencing parameterisation at 22:30 54sec Fri 3 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	22:30 54sec Fri 3 Nov 2006
---vdW_par_bss---
started	22:40 05sec Fri 3 Nov 2006
commencing parameterisation at 22:41 03sec Fri 3 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	22:41 03sec Fri 3 Nov 2006
---vdW_par_bss---
started	22:45 35sec Fri 3 Nov 2006
commencing parameterisation at 22:46 35sec Fri 3 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	22:46 35sec Fri 3 Nov 2006
---vdW_par_bss---
started	23:13 05sec Fri 3 Nov 2006
---vdW_par_bss---
started	23:14 50sec Fri 3 Nov 2006
commencing parameterisation at 23:15 46sec Fri 3 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	23:15 46sec Fri 3 Nov 2006
---vdW_par_bss---
started	23:18 46sec Fri 3 Nov 2006
commencing parameterisation at 23:19 46sec Fri 3 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	23:19 46sec Fri 3 Nov 2006
---vdW_par_bss---
started	23:20 42sec Fri 3 Nov 2006
commencing parameterisation at 23:21 39sec Fri 3 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	23:21 39sec Fri 3 Nov 2006
---vdW_par_bss---
started	23:28 17sec Fri 3 Nov 2006
commencing parameterisation at 23:29 13sec Fri 3 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	23:29 14sec Fri 3 Nov 2006
---vdW_par_bss---
started	23:55 26sec Fri 3 Nov 2006
commencing parameterisation at 23:56 07sec Fri 3 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	23:56 07sec Fri 3 Nov 2006
---vdW_par_bss---
started	00:02 48sec Sat 4 Nov 2006
commencing parameterisation at 00:03 31sec Sat 4 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	00:03 31sec Sat 4 Nov 2006
---bss3-21G---
started	00:12 17sec Sat 4 Nov 2006
finished	00:14 10sec Sat 4 Nov 2006
---vdW_par_bss---
started	00:15 25sec Sat 4 Nov 2006
commencing parameterisation at 00:17 05sec Sat 4 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N8
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	01:17 55sec Sat 4 Nov 2006
---vdW_par_bss---
started	11:39 53sec Sat 4 Nov 2006
commencing parameterisation at 11:41 35sec Sat 4 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N8
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	12:43 03sec Sat 4 Nov 2006
---vdW_par_bss---
started	13:18 41sec Sat 4 Nov 2006
commencing parameterisation at 13:20 24sec Sat 4 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N8
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	14:21 09sec Sat 4 Nov 2006
---bss3-21G---
started	21:20 15sec Wed 8 Nov 2006
---bss3-21G---
started	21:20 42sec Wed 8 Nov 2006
---bss3-21G---
started	21:26 34sec Wed 8 Nov 2006
---bss3-21G---
started	21:31 54sec Wed 8 Nov 2006
finished	21:36 39sec Wed 8 Nov 2006
---bss3-21G---
started	21:53 29sec Wed 8 Nov 2006
finished	21:58 43sec Wed 8 Nov 2006
---bss3-21G---
started	22:18 43sec Wed 8 Nov 2006
finished	22:23 58sec Wed 8 Nov 2006
---steric_par_bss---
started	20:36 11sec Thu 9 Nov 2006
commencing parameterisation at 20:44 48sec Thu 9 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
---steric_par_bss---
started	22:31 46sec Thu 9 Nov 2006
commencing parameterisation at 22:36 29sec Thu 9 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
3	6	9	12
---steric_par_bss---
started	22:41 00sec Thu 9 Nov 2006
---steric_par_bss---
started	22:42 29sec Thu 9 Nov 2006
commencing parameterisation at 22:46 43sec Thu 9 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	12:42 41sec Fri 10 Nov 2006
---steric_par_bss---
started	14:12 19sec Fri 10 Nov 2006
---bss3-21G---
started	15:49 17sec Fri 10 Nov 2006
finished	15:51 23sec Fri 10 Nov 2006
---bss3-21G---
started	15:53 33sec Fri 10 Nov 2006
finished	15:55 35sec Fri 10 Nov 2006
---steric_par_bss---
started	16:06 20sec Fri 10 Nov 2006
commencing parameterisation at 16:10 35sec Fri 10 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	16:46 01sec Fri 10 Nov 2006
---steric_par_bss---
started	11:28 27sec Sat 11 Nov 2006
commencing parameterisation at 11:32 55sec Sat 11 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	12:08 09sec Sat 11 Nov 2006
---steric_par_bss---
started	12:17 05sec Sat 11 Nov 2006
commencing parameterisation at 12:21 35sec Sat 11 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	12:57 08sec Sat 11 Nov 2006
---steric_par_bss---
started	14:46 21sec Sat 11 Nov 2006
commencing parameterisation at 14:50 47sec Sat 11 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	15:12 04sec Sat 11 Nov 2006
---steric_par_bss---
started	15:39 21sec Sat 11 Nov 2006
commencing parameterisation at 15:43 43sec Sat 11 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	16:04 59sec Sat 11 Nov 2006
---steric_par_bss---
started	16:18 48sec Sat 11 Nov 2006
commencing parameterisation at 16:23 07sec Sat 11 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	16:58 29sec Sat 11 Nov 2006
---vdW_par_bss---
started	19:28 45sec Sat 11 Nov 2006
commencing parameterisation at 19:33 20sec Sat 11 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
3	4
finished	19:33 24sec Sat 11 Nov 2006
---vdW_par_bss---
started	20:08 31sec Sat 11 Nov 2006
commencing parameterisation at 20:13 23sec Sat 11 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	7	8
---vdW_par_bss---
started	23:16 07sec Sat 11 Nov 2006
commencing parameterisation at 23:20 34sec Sat 11 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	7
finished	23:20 38sec Sat 11 Nov 2006
---vdW_par_bss---
started	23:53 19sec Sat 11 Nov 2006
commencing parameterisation at 23:57 51sec Sat 11 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
7	8
finished	23:57 56sec Sat 11 Nov 2006
---morse_par_bss---
started	17:48 20sec Tue 14 Nov 2006
---morse_par_bss---
started	17:52 03sec Tue 14 Nov 2006
---morse_par_bss---
started	17:56 34sec Tue 14 Nov 2006
---morse_par_bss---
started	17:59 59sec Tue 14 Nov 2006
---morse_par_bss---
started	18:16 39sec Tue 14 Nov 2006
---morse_par_bss---
started	18:17 50sec Tue 14 Nov 2006
---morse_par_bss---
started	18:27 23sec Tue 14 Nov 2006
---morse_par_bss---
started	18:28 42sec Tue 14 Nov 2006
---morse_par_bss---
started	18:29 23sec Tue 14 Nov 2006
---morse_par_bss---
started	18:30 12sec Tue 14 Nov 2006
---morse_par_bss---
started	18:49 05sec Tue 14 Nov 2006
---morse_par_bss---
started	18:52 45sec Tue 14 Nov 2006
---morse_par_bss---
started	18:56 07sec Tue 14 Nov 2006
---morse_par_bss---
started	18:59 33sec Tue 14 Nov 2006
---morse_par_bss---
started	19:00 24sec Tue 14 Nov 2006
---morse_par_bss---
started	19:01 03sec Tue 14 Nov 2006
---morse_par_bss---
started	19:27 46sec Tue 14 Nov 2006
---morse_par_bss---
started	19:29 05sec Tue 14 Nov 2006
---morse_par_bss---
started	19:36 41sec Tue 14 Nov 2006
---morse_par_bss---
started	21:13 07sec Tue 14 Nov 2006
---morse_par_bss---
started	21:16 25sec Tue 14 Nov 2006
---morse_par_bss---
started	21:20 53sec Tue 14 Nov 2006
finished	21:20 56sec Tue 14 Nov 2006
---morse_par_bss---
started	21:37 28sec Tue 14 Nov 2006
---morse_par_bss---
started	21:39 30sec Tue 14 Nov 2006
finished	21:39 33sec Tue 14 Nov 2006
---morse_par_bss---
started	21:41 00sec Tue 14 Nov 2006
finished	21:41 03sec Tue 14 Nov 2006
---morse_par_bss---
started	21:47 02sec Tue 14 Nov 2006
finished	21:47 05sec Tue 14 Nov 2006
---morse_par_bss---
started	22:31 12sec Tue 14 Nov 2006
finished	22:31 25sec Tue 14 Nov 2006
---morse_par_bss---
started	22:34 15sec Tue 14 Nov 2006
finished	22:34 18sec Tue 14 Nov 2006
---morse_par_bss---
started	22:40 09sec Tue 14 Nov 2006
finished	22:40 12sec Tue 14 Nov 2006
---morse_par_bss---
started	22:52 18sec Tue 14 Nov 2006
finished	22:52 21sec Tue 14 Nov 2006
---morse_par_bss---
started	23:00 43sec Tue 14 Nov 2006
finished	23:00 46sec Tue 14 Nov 2006
---morse_par_bss---
started	23:08 20sec Tue 14 Nov 2006
finished	23:08 23sec Tue 14 Nov 2006
---vdW_par_bss---
started	02:06 35sec Wed 15 Nov 2006
commencing parameterisation at 02:11 05sec Wed 15 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
7	8
finished	02:11 10sec Wed 15 Nov 2006
---morse_par_bss---
started	02:27 20sec Wed 15 Nov 2006
finished	02:27 24sec Wed 15 Nov 2006
---morse_par_bss---
started	02:35 42sec Wed 15 Nov 2006
finished	02:35 45sec Wed 15 Nov 2006
---morse_par_bss---
started	17:11 08sec Wed 15 Nov 2006
finished	17:11 13sec Wed 15 Nov 2006
---morse_par_bss---
started	17:12 19sec Wed 15 Nov 2006
finished	17:12 22sec Wed 15 Nov 2006
---morse_par_bss---
started	17:16 01sec Wed 15 Nov 2006
finished	17:16 04sec Wed 15 Nov 2006
---morse_par_bss---
started	17:21 14sec Wed 15 Nov 2006
finished	17:21 17sec Wed 15 Nov 2006
---morse_par_bss---
started	17:22 06sec Wed 15 Nov 2006
finished	17:22 09sec Wed 15 Nov 2006
---morse_par_bss---
started	17:22 49sec Wed 15 Nov 2006
finished	17:22 52sec Wed 15 Nov 2006
---morse_par_bss---
started	17:23 25sec Wed 15 Nov 2006
finished	17:23 28sec Wed 15 Nov 2006
---morse_par_bss---
started	17:25 32sec Wed 15 Nov 2006
finished	17:25 34sec Wed 15 Nov 2006
---morse_par_bss---
started	18:03 35sec Wed 15 Nov 2006
finished	18:03 38sec Wed 15 Nov 2006
---morse_par_bss---
started	18:05 21sec Wed 15 Nov 2006
finished	18:05 24sec Wed 15 Nov 2006
---morse_par_bss---
started	18:05 58sec Wed 15 Nov 2006
finished	18:06 01sec Wed 15 Nov 2006
---morse_par_bss---
started	18:10 07sec Wed 15 Nov 2006
finished	18:10 09sec Wed 15 Nov 2006
---morse_par_bss---
started	18:10 54sec Wed 15 Nov 2006
finished	18:10 56sec Wed 15 Nov 2006
---morse_par_bss---
started	18:12 38sec Wed 15 Nov 2006
finished	18:12 41sec Wed 15 Nov 2006
---morse_par_bss---
started	23:19 05sec Sun 19 Nov 2006
---morse_par_bss---
started	23:19 52sec Sun 19 Nov 2006
---morse_par_bss---
started	23:22 40sec Sun 19 Nov 2006
finished	23:22 49sec Sun 19 Nov 2006
---morse_par_bss---
started	23:24 15sec Sun 19 Nov 2006
finished	23:24 24sec Sun 19 Nov 2006
---morse_par_bss---
started	23:31 55sec Sun 19 Nov 2006
finished	23:32 04sec Sun 19 Nov 2006
---morse_par_bss---
started	23:33 33sec Sun 19 Nov 2006
finished	23:33 42sec Sun 19 Nov 2006
---morse_par_bss---
started	23:35 21sec Sun 19 Nov 2006
finished	23:35 29sec Sun 19 Nov 2006
---morse_par_bss---
started	21:01 33sec Mon 20 Nov 2006
finished	21:01 41sec Mon 20 Nov 2006
---morse_par_bss---
started	23:21 36sec Mon 20 Nov 2006
finished	23:21 44sec Mon 20 Nov 2006
---morse_par_bss---
started	23:24 15sec Mon 20 Nov 2006
finished	23:24 23sec Mon 20 Nov 2006
---morse_par_bss---
started	23:26 24sec Mon 20 Nov 2006
finished	23:26 32sec Mon 20 Nov 2006
---morse_par_bss---
started	23:50 48sec Mon 20 Nov 2006
finished	23:50 56sec Mon 20 Nov 2006
---morse_par_bss---
started	23:54 23sec Mon 20 Nov 2006
finished	23:54 31sec Mon 20 Nov 2006
---steric_par_bss---
started	11:27 18sec Fri 24 Nov 2006
---morse_par_bss---
started	11:31 23sec Fri 24 Nov 2006
finished	11:31 32sec Fri 24 Nov 2006
---morse_par_bss---
started	11:34 48sec Fri 24 Nov 2006
finished	11:34 56sec Fri 24 Nov 2006
---morse_par_bss---
started	16:08 51sec Fri 24 Nov 2006
finished	16:09 00sec Fri 24 Nov 2006
---morse_par_bss---
started	16:09 48sec Fri 24 Nov 2006
finished	16:09 56sec Fri 24 Nov 2006
---morse_par_bss---
started	16:10 54sec Fri 24 Nov 2006
finished	16:11 03sec Fri 24 Nov 2006
---morse_par_bss---
started	16:13 28sec Fri 24 Nov 2006
finished	16:13 36sec Fri 24 Nov 2006
---morse_par_bss---
started	16:14 50sec Fri 24 Nov 2006
finished	16:14 58sec Fri 24 Nov 2006
---morse_par_bss---
started	16:15 33sec Fri 24 Nov 2006
finished	16:15 41sec Fri 24 Nov 2006
---morse_par_bss---
started	16:16 08sec Fri 24 Nov 2006
finished	16:16 16sec Fri 24 Nov 2006
---morse_par_bss---
started	16:19 57sec Fri 24 Nov 2006
finished	16:20 05sec Fri 24 Nov 2006
---morse_par_bss---
started	23:17 52sec Fri 24 Nov 2006
finished	23:18 00sec Fri 24 Nov 2006
---morse_par_bss---
started	23:20 22sec Fri 24 Nov 2006
finished	23:20 31sec Fri 24 Nov 2006
---morse_par_bss---
started	23:23 15sec Fri 24 Nov 2006
finished	23:23 23sec Fri 24 Nov 2006
---morse_par_bss---
started	23:24 48sec Fri 24 Nov 2006
---morse_par_bss---
started	23:26 15sec Fri 24 Nov 2006
finished	23:26 37sec Fri 24 Nov 2006
---morse_par_bss---
started	23:29 15sec Fri 24 Nov 2006
finished	23:29 38sec Fri 24 Nov 2006
---morse_par_bss---
started	23:36 38sec Fri 24 Nov 2006
finished	23:36 59sec Fri 24 Nov 2006
---morse_par_bss---
started	10:29 55sec Sat 25 Nov 2006
finished	10:30 18sec Sat 25 Nov 2006
---morse_par_bss---
started	11:34 10sec Sat 25 Nov 2006
finished	11:34 35sec Sat 25 Nov 2006
---morse_par_bss---
started	11:36 10sec Sat 25 Nov 2006
finished	11:36 32sec Sat 25 Nov 2006
---morse_par_bss---
started	11:39 23sec Sat 25 Nov 2006
finished	11:39 45sec Sat 25 Nov 2006
---morse_par_bss---
started	11:42 11sec Sat 25 Nov 2006
finished	11:42 34sec Sat 25 Nov 2006
---morse_par_bss---
started	11:55 42sec Sat 25 Nov 2006
finished	11:56 04sec Sat 25 Nov 2006
---morse_par_bss---
started	12:28 57sec Sat 25 Nov 2006
finished	12:29 23sec Sat 25 Nov 2006
---morse_par_bss---
started	12:37 36sec Sat 25 Nov 2006
finished	12:38 00sec Sat 25 Nov 2006
---morse_par_bss---
started	12:41 36sec Sat 25 Nov 2006
finished	12:42 00sec Sat 25 Nov 2006
---morse_par_bss---
started	12:46 10sec Sat 25 Nov 2006
finished	12:46 32sec Sat 25 Nov 2006
---morse_par_bss---
started	12:48 08sec Sat 25 Nov 2006
finished	12:48 31sec Sat 25 Nov 2006
---morse_par_bss---
started	12:49 52sec Sat 25 Nov 2006
finished	12:50 14sec Sat 25 Nov 2006
---morse_par_bss---
started	14:59 31sec Sat 25 Nov 2006
finished	14:59 53sec Sat 25 Nov 2006
---morse_par_bss---
started	15:06 13sec Sat 25 Nov 2006
finished	15:06 35sec Sat 25 Nov 2006
---morse_par_bss---
started	15:17 19sec Sat 25 Nov 2006
finished	15:17 41sec Sat 25 Nov 2006
---morse_par_bss---
started	15:19 08sec Sat 25 Nov 2006
finished	15:19 30sec Sat 25 Nov 2006
---morse_par_bss---
started	15:30 42sec Sat 25 Nov 2006
finished	15:31 04sec Sat 25 Nov 2006
---morse_par_bss---
started	15:48 57sec Sat 25 Nov 2006
finished	15:49 19sec Sat 25 Nov 2006
---morse_par_bss---
started	15:50 49sec Sat 25 Nov 2006
finished	15:51 11sec Sat 25 Nov 2006
---morse_par_bss---
started	15:58 13sec Sat 25 Nov 2006
finished	15:58 35sec Sat 25 Nov 2006
---morse_par_bss---
started	17:46 05sec Sat 25 Nov 2006
finished	17:46 27sec Sat 25 Nov 2006
---morse_par_bss---
started	17:59 21sec Sat 25 Nov 2006
finished	17:59 43sec Sat 25 Nov 2006
---morse_par_bss---
started	18:02 44sec Sat 25 Nov 2006
finished	18:03 05sec Sat 25 Nov 2006
---morse_par_bss---
started	18:03 34sec Sat 25 Nov 2006
finished	18:03 57sec Sat 25 Nov 2006
---morse_par_bss---
started	18:12 45sec Sat 25 Nov 2006
finished	18:13 07sec Sat 25 Nov 2006
---morse_par_bss---
started	18:18 40sec Sat 25 Nov 2006
finished	18:19 02sec Sat 25 Nov 2006
---morse_par_bss---
started	18:22 14sec Sat 25 Nov 2006
finished	18:22 36sec Sat 25 Nov 2006
---morse_par_bss---
started	18:26 59sec Sat 25 Nov 2006
finished	18:27 22sec Sat 25 Nov 2006
---morse_par_bss---
started	18:29 53sec Sat 25 Nov 2006
finished	18:30 15sec Sat 25 Nov 2006
---morse_par_bss---
started	18:31 17sec Sat 25 Nov 2006
finished	18:31 40sec Sat 25 Nov 2006
---morse_par_bss---
started	18:37 11sec Sat 25 Nov 2006
finished	18:37 33sec Sat 25 Nov 2006
---morse_par_bss---
started	18:39 00sec Sat 25 Nov 2006
---morse_par_bss---
started	18:39 46sec Sat 25 Nov 2006
finished	18:40 07sec Sat 25 Nov 2006
---morse_par_bss---
started	18:40 40sec Sat 25 Nov 2006
finished	18:41 02sec Sat 25 Nov 2006
---morse_par_bss---
started	18:42 02sec Sat 25 Nov 2006
finished	18:42 23sec Sat 25 Nov 2006
---morse_par_bss---
started	18:42 48sec Sat 25 Nov 2006
finished	18:43 10sec Sat 25 Nov 2006
---morse_par_bss---
started	18:57 19sec Sat 25 Nov 2006
finished	18:57 41sec Sat 25 Nov 2006
---morse_par_bss---
started	19:03 27sec Sat 25 Nov 2006
finished	19:03 49sec Sat 25 Nov 2006
---morse_par_bss---
started	19:12 06sec Sat 25 Nov 2006
---morse_par_bss---
started	19:12 42sec Sat 25 Nov 2006
---morse_par_bss---
started	22:23 48sec Sat 25 Nov 2006
---morse_par_bss---
started	22:30 02sec Sat 25 Nov 2006
---morse_par_bss---
started	22:34 42sec Sat 25 Nov 2006
---morse_par_bss---
started	22:36 11sec Sat 25 Nov 2006
---morse_par_bss---
started	22:37 47sec Sat 25 Nov 2006
---morse_par_bss---
started	22:41 42sec Sat 25 Nov 2006
---morse_par_bss---
started	22:45 39sec Sat 25 Nov 2006
---morse_par_bss---
started	22:47 32sec Sat 25 Nov 2006
---morse_par_bss---
started	22:52 31sec Sat 25 Nov 2006
---morse_par_bss---
started	22:55 38sec Sat 25 Nov 2006
---morse_par_bss---
started	22:57 57sec Sat 25 Nov 2006
---morse_par_bss---
started	23:03 22sec Sat 25 Nov 2006
---morse_par_bss---
started	23:28 49sec Sat 25 Nov 2006
finished	23:29 35sec Sat 25 Nov 2006
---morse_par_bss---
started	23:32 41sec Sat 25 Nov 2006
finished	23:33 25sec Sat 25 Nov 2006
---morse_par_bss---
started	23:35 58sec Sat 25 Nov 2006
finished	23:36 41sec Sat 25 Nov 2006
---morse_par_bss---
started	12:33 23sec Sun 26 Nov 2006
---morse_par_bss---
started	12:36 02sec Sun 26 Nov 2006
finished	12:36 59sec Sun 26 Nov 2006
---morse_par_bss---
started	18:39 11sec Sun 26 Nov 2006
---morse_par_bss---
started	18:42 06sec Sun 26 Nov 2006
---morse_par_bss---
started	18:48 55sec Sun 26 Nov 2006
---morse_par_bss---
started	18:51 15sec Sun 26 Nov 2006
---morse_par_bss---
started	18:53 34sec Sun 26 Nov 2006
finished	18:54 28sec Sun 26 Nov 2006
---morse_par_bss---
started	19:09 14sec Sun 26 Nov 2006
---morse_par_bss---
started	19:32 28sec Sun 26 Nov 2006
---morse_par_bss---
started	19:37 29sec Sun 26 Nov 2006
finished	19:38 32sec Sun 26 Nov 2006
---morse_par_bss---
started	19:44 35sec Sun 26 Nov 2006
---morse_par_bss---
started	23:41 41sec Sun 26 Nov 2006
finished	23:42 27sec Sun 26 Nov 2006
---morse_par_bss---
started	23:45 52sec Sun 26 Nov 2006
finished	23:47 01sec Sun 26 Nov 2006
---morse_par_bss---
started	23:47 35sec Sun 26 Nov 2006
---morse_par_bss---
started	23:51 48sec Sun 26 Nov 2006
finished	23:53 43sec Sun 26 Nov 2006
---morse_par_bss---
started	23:54 09sec Sun 26 Nov 2006
finished	23:55 40sec Sun 26 Nov 2006
---morse_par_bss---
started	23:55 44sec Sun 26 Nov 2006
---morse_par_bss---
started	23:56 58sec Sun 26 Nov 2006
finished	23:58 01sec Sun 26 Nov 2006
---morse_par_bss---
started	23:58 33sec Sun 26 Nov 2006
finished	23:59 37sec Sun 26 Nov 2006
---morse_par_bss---
started	23:59 45sec Sun 26 Nov 2006
---morse_par_bss---
started	00:06 18sec Mon 27 Nov 2006
finished	00:07 05sec Mon 27 Nov 2006
---morse_par_bss---
started	00:27 33sec Mon 27 Nov 2006
---morse_par_bss---
started	00:29 29sec Mon 27 Nov 2006
---morse_par_bss---
started	00:32 44sec Mon 27 Nov 2006
---morse_par_bss---
started	00:41 44sec Mon 27 Nov 2006
---vdW_par_bss---
started	10:32 49sec Mon 27 Nov 2006
commencing parameterisation at 10:33 41sec Mon 27 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
4	5	6	7	8	9	10	11
finished	10:33 41sec Mon 27 Nov 2006
---vdW_par_bss---
started	10:53 36sec Mon 27 Nov 2006
---vdW_par_bss---
started	10:58 38sec Mon 27 Nov 2006
---vdW_par_bss---
started	10:58 48sec Mon 27 Nov 2006
commencing parameterisation at 11:02 12sec Mon 27 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	12:04 05sec Mon 27 Nov 2006
---vdW_par_bss---
started	12:39 08sec Mon 27 Nov 2006
commencing parameterisation at 12:42 33sec Mon 27 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	13:50 50sec Mon 27 Nov 2006
---vdW_par_bss---
started	16:31 32sec Mon 27 Nov 2006
commencing parameterisation at 16:34 57sec Mon 27 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
---vdW_par_bss---
started	18:35 02sec Mon 27 Nov 2006
commencing parameterisation at 18:38 28sec Mon 27 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	19:28 34sec Mon 27 Nov 2006
---vdW_par_bss---
started	21:47 12sec Mon 27 Nov 2006
commencing parameterisation at 21:50 35sec Mon 27 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	22:40 33sec Mon 27 Nov 2006
---vdW_par_bss---
started	22:55 36sec Mon 27 Nov 2006
commencing parameterisation at 22:58 57sec Mon 27 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
---vdW_par_bss---
started	23:43 16sec Mon 27 Nov 2006
commencing parameterisation at 23:46 32sec Mon 27 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	00:36 56sec Tue 28 Nov 2006
---vdW_par_bss---
started	13:50 27sec Tue 28 Nov 2006
commencing parameterisation at 13:53 59sec Tue 28 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	14:44 49sec Tue 28 Nov 2006
---vdW_par_bss---
started	15:20 44sec Tue 28 Nov 2006
commencing parameterisation at 15:21 59sec Tue 28 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	15:21 59sec Tue 28 Nov 2006
---vdW_par_bss---
started	15:23 07sec Tue 28 Nov 2006
commencing parameterisation at 15:24 21sec Tue 28 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	15:24 21sec Tue 28 Nov 2006
---vdW_par_bss---
started	15:30 07sec Tue 28 Nov 2006
commencing parameterisation at 15:31 21sec Tue 28 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	15:31 21sec Tue 28 Nov 2006
---vdW_par_bss---
started	15:34 39sec Tue 28 Nov 2006
commencing parameterisation at 15:35 54sec Tue 28 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	15:35 55sec Tue 28 Nov 2006
---vdW_par_bss---
started	15:56 09sec Tue 28 Nov 2006
commencing parameterisation at 15:57 19sec Tue 28 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	7	8	9	10	11	12
finished	15:57 19sec Tue 28 Nov 2006
---vdW_par_bss---
started	16:00 00sec Tue 28 Nov 2006
commencing parameterisation at 16:01 11sec Tue 28 Nov 2006.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	7	8	9	10	11	12
finished	16:01 11sec Tue 28 Nov 2006
---bss3-21G---
started	21:47 30sec Tue 28 Nov 2006
finished	21:48 34sec Tue 28 Nov 2006
---bss3-21G---
started	21:52 09sec Tue 28 Nov 2006
---bss3-21G---
started	21:53 27sec Tue 28 Nov 2006
finished	21:54 21sec Tue 28 Nov 2006
---bss3-21G---
started	10:51 48sec Wed 29 Nov 2006
finished	10:52 35sec Wed 29 Nov 2006
---bss3-21G---
started	11:23 02sec Wed 29 Nov 2006
finished	11:23 49sec Wed 29 Nov 2006
---bss3-21G---
started	11:32 34sec Wed 29 Nov 2006
finished	11:33 19sec Wed 29 Nov 2006
---bss3-21G---
started	11:58 57sec Wed 29 Nov 2006
---bss3-21G---
started	11:59 58sec Wed 29 Nov 2006
finished	12:00 45sec Wed 29 Nov 2006
---bss3-21G---
started	12:04 20sec Wed 29 Nov 2006
---bss3-21G---
started	12:05 26sec Wed 29 Nov 2006
finished	12:06 12sec Wed 29 Nov 2006
---bss3-21G---
started	12:11 36sec Wed 29 Nov 2006
finished	12:12 22sec Wed 29 Nov 2006
---bss3-21G---
started	12:14 47sec Wed 29 Nov 2006
finished	12:15 34sec Wed 29 Nov 2006
---bss3-21G---
started	12:44 45sec Wed 29 Nov 2006
finished	12:45 31sec Wed 29 Nov 2006
---bss3-21G---
started	12:46 32sec Wed 29 Nov 2006
finished	12:47 18sec Wed 29 Nov 2006
---vdW_par_bss---
started	13:09 19sec Wed 29 Nov 2006
commencing parameterisation at 13:12 26sec Wed 29 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	7	8	9	10	11	12
finished	13:16 47sec Wed 29 Nov 2006
---vdW_par_bss---
started	13:25 29sec Wed 29 Nov 2006
commencing parameterisation at 13:28 38sec Wed 29 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	7	8	9	10	11	12
finished	13:33 46sec Wed 29 Nov 2006
---vdW_par_bss---
started	13:40 21sec Wed 29 Nov 2006
commencing parameterisation at 13:43 28sec Wed 29 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	7	8	9	10	11	12
finished	13:48 37sec Wed 29 Nov 2006
---vdW_par_bss---
started	13:54 06sec Wed 29 Nov 2006
commencing parameterisation at 13:57 26sec Wed 29 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	14:48 26sec Wed 29 Nov 2006
---vdW_par_bss---
started	15:00 00sec Wed 29 Nov 2006
commencing parameterisation at 15:03 22sec Wed 29 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	15:54 09sec Wed 29 Nov 2006
---bss3-21G---
started	22:36 12sec Wed 29 Nov 2006
finished	22:36 58sec Wed 29 Nov 2006
---bss3-21G---
started	22:39 05sec Wed 29 Nov 2006
finished	22:39 52sec Wed 29 Nov 2006
---vdW_par_bss---
started	23:02 41sec Wed 29 Nov 2006
---vdW_par_bss---
started	23:03 31sec Wed 29 Nov 2006
commencing parameterisation at 23:04 25sec Wed 29 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	23:16 30sec Wed 29 Nov 2006
---bss3-21G---
started	09:46 17sec Thu 30 Nov 2006
finished	09:47 03sec Thu 30 Nov 2006
---bss3-21G---
started	09:51 03sec Thu 30 Nov 2006
finished	09:51 46sec Thu 30 Nov 2006
---morse_par_bss---
started	11:38 31sec Thu 30 Nov 2006
---morse_par_bss---
started	11:40 07sec Thu 30 Nov 2006
---morse_par_bss---
started	12:29 21sec Thu 30 Nov 2006
---morse_par_bss---
started	12:34 41sec Thu 30 Nov 2006
---morse_par_bss---
started	12:48 45sec Thu 30 Nov 2006
---morse_par_bss---
started	12:52 22sec Thu 30 Nov 2006
---morse_par_bss---
started	12:54 31sec Thu 30 Nov 2006
---morse_par_bss---
started	12:57 54sec Thu 30 Nov 2006
---morse_par_bss---
started	12:59 59sec Thu 30 Nov 2006
---morse_par_bss---
started	13:08 28sec Thu 30 Nov 2006
---morse_par_bss---
started	13:43 04sec Thu 30 Nov 2006
---morse_par_bss---
started	13:46 17sec Thu 30 Nov 2006
---morse_par_bss---
started	14:42 56sec Thu 30 Nov 2006
---morse_par_bss---
started	14:49 18sec Thu 30 Nov 2006
---morse_par_bss---
started	14:50 00sec Thu 30 Nov 2006
---morse_par_bss---
started	15:07 34sec Thu 30 Nov 2006
---vdW_par_bss---
started	15:21 52sec Thu 30 Nov 2006
commencing parameterisation at 15:22 48sec Thu 30 Nov 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	15:35 00sec Thu 30 Nov 2006
---vdW_par_bss---
started	01:51 44sec Sat 2 Dec 2006
commencing parameterisation at 01:52 38sec Sat 2 Dec 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	02:04 46sec Sat 2 Dec 2006
---vdW_par_bss---
started	10:55 20sec Sat 2 Dec 2006
commencing parameterisation at 10:56 17sec Sat 2 Dec 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	11:09 50sec Sat 2 Dec 2006
---vdW_par_bss---
started	11:58 23sec Sat 2 Dec 2006
---vdW_par_bss---
started	11:58 54sec Sat 2 Dec 2006
commencing parameterisation at 11:59 48sec Sat 2 Dec 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	12:15 36sec Sat 2 Dec 2006
---morse_par_bss---
started	12:49 30sec Sat 2 Dec 2006
---vdW_par_bss---
started	13:52 55sec Sat 2 Dec 2006
commencing parameterisation at 13:56 14sec Sat 2 Dec 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	14:46 04sec Sat 2 Dec 2006
---vdW_par_bss---
started	14:59 56sec Sat 2 Dec 2006
commencing parameterisation at 15:03 14sec Sat 2 Dec 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	16:12 55sec Sat 2 Dec 2006
---vdW_par_bss---
started	16:21 07sec Sat 2 Dec 2006
commencing parameterisation at 16:24 28sec Sat 2 Dec 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
---vdW_par_bss---
started	17:25 54sec Sat 2 Dec 2006
commencing parameterisation at 17:29 28sec Sat 2 Dec 2006.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	18:38 47sec Sat 2 Dec 2006
---morse_par_bss---
started	16:16 51sec Mon 18 Dec 2006
finished	16:20 05sec Mon 18 Dec 2006
---morse_par_bss---
started	15:32 23sec Thu 4 Jan 2007
---bss3-21G---
started	17:12 33sec Fri 19 Jan 2007
finished	17:15 22sec Fri 19 Jan 2007
---bss3-21G---
started	13:25 45sec Sat 20 Jan 2007
---bss3-21G---
started	13:26 01sec Sat 20 Jan 2007
---bss3-21G---
started	13:33 16sec Sat 20 Jan 2007
---bss3-21G---
started	14:06 04sec Sat 20 Jan 2007
---bss3-21G---
started	14:29 34sec Sat 20 Jan 2007
finished	14:30 13sec Sat 20 Jan 2007
---vdW_par_bss---
started	14:35 21sec Sat 20 Jan 2007
commencing parameterisation at 14:35 58sec Sat 20 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
---vdW_par_bss---
started	14:36 55sec Sat 20 Jan 2007
commencing parameterisation at 14:37 43sec Sat 20 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	14:47 00sec Sat 20 Jan 2007
---bss3-21G---
started	14:48 26sec Sat 20 Jan 2007
finished	14:49 04sec Sat 20 Jan 2007
---bss3-21G---
started	17:14 35sec Sat 20 Jan 2007
---bss3-21G---
started	17:17 05sec Sat 20 Jan 2007
finished	17:17 48sec Sat 20 Jan 2007
---bss3-21G---
started	17:20 31sec Sat 20 Jan 2007
---bss3-21G---
started	17:38 26sec Sat 20 Jan 2007
---bss3-21G---
started	17:38 43sec Sat 20 Jan 2007
---bss3-21G---
started	17:40 43sec Sat 20 Jan 2007
---bss3-21G---
started	17:41 32sec Sat 20 Jan 2007
---bss3-21G---
started	17:43 09sec Sat 20 Jan 2007
---bss3-21G---
started	17:43 32sec Sat 20 Jan 2007
---bss3-21G---
started	17:53 00sec Sat 20 Jan 2007
---bss3-21G---
started	17:53 43sec Sat 20 Jan 2007
finished	17:54 30sec Sat 20 Jan 2007
---bss3-21G---
started	17:55 44sec Sat 20 Jan 2007
finished	17:56 25sec Sat 20 Jan 2007
---bss3-21G---
started	17:59 42sec Sat 20 Jan 2007
finished	18:00 26sec Sat 20 Jan 2007
---bss3-21G---
started	18:02 43sec Sat 20 Jan 2007
---bss3-21G---
started	18:07 04sec Sat 20 Jan 2007
---bss3-21G---
started	18:08 03sec Sat 20 Jan 2007
finished	18:08 54sec Sat 20 Jan 2007
---bss3-21G---
started	18:10 00sec Sat 20 Jan 2007
---bss3-21G---
started	18:16 06sec Sat 20 Jan 2007
finished	18:16 54sec Sat 20 Jan 2007
---bss3-21G---
started	21:03 31sec Sat 20 Jan 2007
---bss3-21G---
started	21:05 00sec Sat 20 Jan 2007
---bss3-21G---
started	21:44 13sec Sun 21 Jan 2007
finished	21:44 56sec Sun 21 Jan 2007
---bss3-21G---
started	21:52 19sec Sun 21 Jan 2007
---bss3-21G---
started	21:56 32sec Sun 21 Jan 2007
finished	21:57 12sec Sun 21 Jan 2007
---bss3-21G---
started	21:57 31sec Sun 21 Jan 2007
finished	21:58 12sec Sun 21 Jan 2007
---bss3-21G---
started	21:58 48sec Sun 21 Jan 2007
finished	21:59 28sec Sun 21 Jan 2007
---bss3-21G---
started	22:04 46sec Sun 21 Jan 2007
finished	22:05 26sec Sun 21 Jan 2007
---bss3-21G---
started	22:19 39sec Sun 21 Jan 2007
finished	22:20 19sec Sun 21 Jan 2007
---bss3-21G---
started	22:33 37sec Sun 21 Jan 2007
finished	22:34 17sec Sun 21 Jan 2007
---bss3-21G---
started	22:35 30sec Sun 21 Jan 2007
finished	22:36 10sec Sun 21 Jan 2007
---bss3-21G---
started	22:50 23sec Sun 21 Jan 2007
finished	22:51 02sec Sun 21 Jan 2007
---bss3-21G---
started	22:51 42sec Sun 21 Jan 2007
finished	22:52 24sec Sun 21 Jan 2007
---bss3-21G---
started	23:05 41sec Sun 21 Jan 2007
finished	23:06 21sec Sun 21 Jan 2007
---bss3-21G---
started	23:13 55sec Sun 21 Jan 2007
finished	23:14 35sec Sun 21 Jan 2007
---bss3-21G---
started	23:16 18sec Sun 21 Jan 2007
---bss3-21G---
started	23:18 17sec Sun 21 Jan 2007
---bss3-21G---
started	23:26 30sec Sun 21 Jan 2007
---bss3-21G---
started	23:35 25sec Sun 21 Jan 2007
finished	23:36 13sec Sun 21 Jan 2007
---bss3-21G---
started	23:38 47sec Sun 21 Jan 2007
finished	23:39 35sec Sun 21 Jan 2007
---bss3-21G---
started	23:41 56sec Sun 21 Jan 2007
finished	23:42 45sec Sun 21 Jan 2007
---bss3-21G---
started	23:53 13sec Sun 21 Jan 2007
finished	23:53 52sec Sun 21 Jan 2007
---bss3-21G---
started	23:57 11sec Sun 21 Jan 2007
finished	23:57 50sec Sun 21 Jan 2007
---bss3-21G---
started	11:18 38sec Mon 22 Jan 2007
finished	11:19 30sec Mon 22 Jan 2007
---bss3-21G---
started	11:22 07sec Mon 22 Jan 2007
finished	11:22 56sec Mon 22 Jan 2007
---bss3-21G---
started	11:43 40sec Mon 22 Jan 2007
finished	11:44 30sec Mon 22 Jan 2007
---bss3-21G---
started	11:49 35sec Mon 22 Jan 2007
finished	11:50 23sec Mon 22 Jan 2007
---bss3-21G---
started	11:51 21sec Mon 22 Jan 2007
finished	11:52 09sec Mon 22 Jan 2007
---bss3-21G---
started	11:54 01sec Mon 22 Jan 2007
finished	11:54 50sec Mon 22 Jan 2007
---bss3-21G---
started	12:17 18sec Mon 22 Jan 2007
finished	12:18 06sec Mon 22 Jan 2007
---bss3-21G---
started	12:21 13sec Mon 22 Jan 2007
finished	12:22 01sec Mon 22 Jan 2007
---bss3-21G---
started	13:42 41sec Mon 22 Jan 2007
finished	13:43 29sec Mon 22 Jan 2007
---bss3-21G---
started	13:44 18sec Mon 22 Jan 2007
finished	13:45 07sec Mon 22 Jan 2007
---bss3-21G---
started	13:47 22sec Mon 22 Jan 2007
---bss3-21G---
started	13:49 24sec Mon 22 Jan 2007
---bss3-21G---
started	13:52 13sec Mon 22 Jan 2007
---bss3-21G---
started	15:39 25sec Wed 24 Jan 2007
finished	15:40 17sec Wed 24 Jan 2007
---bss3-21G---
started	15:42 25sec Wed 24 Jan 2007
finished	15:43 13sec Wed 24 Jan 2007
---bss3-21G---
started	15:58 38sec Wed 24 Jan 2007
---bss3-21G---
started	16:00 41sec Wed 24 Jan 2007
---bss3-21G---
started	16:53 06sec Wed 24 Jan 2007
finished	16:53 53sec Wed 24 Jan 2007
---bss3-21G---
started	16:55 54sec Wed 24 Jan 2007
finished	16:56 45sec Wed 24 Jan 2007
---vdW_par_bss---
started	17:04 58sec Wed 24 Jan 2007
commencing parameterisation at 17:05 47sec Wed 24 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	17:15 04sec Wed 24 Jan 2007
---vdW_par_bss---
started	18:04 19sec Wed 24 Jan 2007
commencing parameterisation at 18:05 07sec Wed 24 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	18:14 23sec Wed 24 Jan 2007
---vdW_par_bss---
started	19:32 12sec Wed 24 Jan 2007
commencing parameterisation at 19:33 00sec Wed 24 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	19:42 16sec Wed 24 Jan 2007
---vdW_par_bss---
started	19:47 12sec Wed 24 Jan 2007
---vdW_par_bss---
started	19:51 19sec Wed 24 Jan 2007
commencing parameterisation at 19:52 41sec Wed 24 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	20:10 57sec Wed 24 Jan 2007
---vdW_par_bss---
started	23:07 51sec Wed 24 Jan 2007
commencing parameterisation at 23:09 14sec Wed 24 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	23:24 35sec Wed 24 Jan 2007
---vdW_par_bss---
started	12:13 05sec Thu 25 Jan 2007
commencing parameterisation at 12:14 06sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9
finished	12:14 07sec Thu 25 Jan 2007
---vdW_par_bss---
started	12:34 25sec Thu 25 Jan 2007
commencing parameterisation at 12:35 23sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9
finished	12:35 23sec Thu 25 Jan 2007
---vdW_par_bss---
started	13:04 28sec Thu 25 Jan 2007
commencing parameterisation at 13:05 27sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9
finished	13:05 27sec Thu 25 Jan 2007
---vdW_par_bss---
started	13:06 25sec Thu 25 Jan 2007
commencing parameterisation at 13:07 23sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9
finished	13:07 23sec Thu 25 Jan 2007
---vdW_par_bss---
started	13:16 59sec Thu 25 Jan 2007
commencing parameterisation at 13:18 06sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	13:33 04sec Thu 25 Jan 2007
---vdW_par_bss---
started	14:05 08sec Thu 25 Jan 2007
commencing parameterisation at 14:06 19sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	14:21 47sec Thu 25 Jan 2007
---vdW_par_bss---
started	17:38 19sec Thu 25 Jan 2007
commencing parameterisation at 17:39 52sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	17:57 37sec Thu 25 Jan 2007
---vdW_par_bss---
started	18:36 39sec Thu 25 Jan 2007
commencing parameterisation at 18:37 40sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	18:37 42sec Thu 25 Jan 2007
---vdW_par_bss---
started	18:48 11sec Thu 25 Jan 2007
commencing parameterisation at 18:49 09sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	18:49 12sec Thu 25 Jan 2007
---vdW_par_bss---
started	19:08 36sec Thu 25 Jan 2007
commencing parameterisation at 19:09 39sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	19:09 43sec Thu 25 Jan 2007
---vdW_par_bss---
started	21:03 10sec Thu 25 Jan 2007
commencing parameterisation at 21:04 16sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	21:04 18sec Thu 25 Jan 2007
---vdW_par_bss---
started	21:34 45sec Thu 25 Jan 2007
commencing parameterisation at 21:35 48sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	21:35 51sec Thu 25 Jan 2007
---vdW_par_bss---
started	22:45 13sec Thu 25 Jan 2007
commencing parameterisation at 22:46 18sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	22:46 21sec Thu 25 Jan 2007
---vdW_par_bss---
started	22:49 52sec Thu 25 Jan 2007
commencing parameterisation at 22:50 53sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	22:50 55sec Thu 25 Jan 2007
---vdW_par_bss---
started	22:53 03sec Thu 25 Jan 2007
commencing parameterisation at 22:54 05sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	22:54 07sec Thu 25 Jan 2007
---vdW_par_bss---
started	23:15 45sec Thu 25 Jan 2007
commencing parameterisation at 23:16 47sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	23:16 49sec Thu 25 Jan 2007
---vdW_par_bss---
started	23:20 18sec Thu 25 Jan 2007
commencing parameterisation at 23:21 20sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	23:21 23sec Thu 25 Jan 2007
---vdW_par_bss---
started	23:26 44sec Thu 25 Jan 2007
commencing parameterisation at 23:27 51sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	23:27 54sec Thu 25 Jan 2007
---vdW_par_bss---
started	23:30 54sec Thu 25 Jan 2007
commencing parameterisation at 23:31 58sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	23:32 01sec Thu 25 Jan 2007
---vdW_par_bss---
started	23:32 36sec Thu 25 Jan 2007
commencing parameterisation at 23:33 41sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	23:33 43sec Thu 25 Jan 2007
---vdW_par_bss---
started	23:39 20sec Thu 25 Jan 2007
commencing parameterisation at 23:40 23sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	23:40 25sec Thu 25 Jan 2007
---vdW_par_bss---
started	23:46 47sec Thu 25 Jan 2007
commencing parameterisation at 23:47 48sec Thu 25 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	23:47 51sec Thu 25 Jan 2007
---vdW_par_bss---
started	00:25 00sec Fri 26 Jan 2007
commencing parameterisation at 00:26 00sec Fri 26 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	00:26 03sec Fri 26 Jan 2007
---bss3-21G---
started	22:49 45sec Tue 30 Jan 2007
finished	22:50 59sec Tue 30 Jan 2007
---bss3-21G---
started	22:56 54sec Tue 30 Jan 2007
finished	22:58 17sec Tue 30 Jan 2007
---vdW_par_bss---
started	23:03 02sec Tue 30 Jan 2007
commencing parameterisation at 23:04 03sec Tue 30 Jan 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	23:04 06sec Tue 30 Jan 2007
---bss3-21G---
started	12:10 19sec Wed 31 Jan 2007
finished	12:11 35sec Wed 31 Jan 2007
---bss3-21G---
started	12:12 18sec Wed 31 Jan 2007
---bss3-21G---
started	12:12 42sec Wed 31 Jan 2007
---bss3-21G---
started	23:34 00sec Wed 31 Jan 2007
finished	23:35 14sec Wed 31 Jan 2007
---bss3-21G---
started	23:48 40sec Wed 31 Jan 2007
finished	23:49 51sec Wed 31 Jan 2007
---bss3-21G---
started	23:57 14sec Wed 31 Jan 2007
---bss3-21G---
started	00:25 12sec Thu 1 Feb 2007
---bss3-21G---
started	00:25 48sec Thu 1 Feb 2007
finished	00:26 59sec Thu 1 Feb 2007
---vdW_par_bss---
started	00:27 46sec Thu 1 Feb 2007
commencing parameterisation at 00:28 47sec Thu 1 Feb 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	00:28 50sec Thu 1 Feb 2007
---bss3-21G---
started	00:37 55sec Sat 3 Feb 2007
finished	00:39 08sec Sat 3 Feb 2007
---vdW_par_bss---
started	00:43 14sec Sat 3 Feb 2007
---vdW_par_bss---
started	00:44 09sec Sat 3 Feb 2007
commencing parameterisation at 00:45 10sec Sat 3 Feb 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	00:45 13sec Sat 3 Feb 2007
---vdW_par_bss---
started	00:45 52sec Sat 3 Feb 2007
commencing parameterisation at 00:46 51sec Sat 3 Feb 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	6	9	12
finished	00:46 53sec Sat 3 Feb 2007
---vdW_par_bss---
started	00:51 23sec Sat 3 Feb 2007
---vdW_par_bss---
started	00:53 11sec Sat 3 Feb 2007
---vdW_par_bss---
started	01:12 24sec Sat 3 Feb 2007
commencing parameterisation at 01:24 01sec Sat 3 Feb 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	01:24 06sec Sat 3 Feb 2007
---vdW_par_bss---
started	01:38 31sec Sat 3 Feb 2007
commencing parameterisation at 01:50 05sec Sat 3 Feb 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	01:50 10sec Sat 3 Feb 2007
---vdW_par_bss---
started	15:06 45sec Sat 3 Feb 2007
commencing parameterisation at 15:18 25sec Sat 3 Feb 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	15:18 31sec Sat 3 Feb 2007
---vdW_par_bss---
started	16:08 28sec Sat 3 Feb 2007
commencing parameterisation at 16:20 02sec Sat 3 Feb 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	16:20 08sec Sat 3 Feb 2007
---morse_par_bss---
started	18:22 56sec Sat 24 Feb 2007
---morse_par_bss---
started	18:10 54sec Tue 13 Mar 2007
---morse_par_bss---
started	18:38 55sec Tue 13 Mar 2007
---morse_par_bss---
started	22:58 12sec Tue 13 Mar 2007
---morse_par_bss---
started	23:26 13sec Tue 13 Mar 2007
---morse_par_bss---
started	23:34 48sec Tue 13 Mar 2007
---morse_par_bss---
started	23:38 36sec Tue 13 Mar 2007
finished	23:41 22sec Tue 13 Mar 2007
---vdW_par_bss---
started	23:55 58sec Tue 13 Mar 2007
commencing parameterisation at 23:58 00sec Tue 13 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	23:58 01sec Tue 13 Mar 2007
---vdW_par_bss---
started	00:02 04sec Wed 14 Mar 2007
---vdW_par_bss---
started	00:21 48sec Wed 14 Mar 2007
commencing parameterisation at 00:23 49sec Wed 14 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	00:23 49sec Wed 14 Mar 2007
---vdW_par_bss---
started	00:53 07sec Wed 14 Mar 2007
commencing parameterisation at 00:55 17sec Wed 14 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	00:55 17sec Wed 14 Mar 2007
---morse_par_bss---
started	00:57 58sec Wed 14 Mar 2007
---morse_par_bss---
started	01:10 25sec Wed 14 Mar 2007
finished	01:12 18sec Wed 14 Mar 2007
---morse_par_bss---
started	11:41 46sec Wed 14 Mar 2007
finished	11:45 10sec Wed 14 Mar 2007
---bss3-21G---
started	21:03 14sec Sat 17 Mar 2007
finished	21:04 50sec Sat 17 Mar 2007
---bss3-21G---
started	21:12 07sec Sat 17 Mar 2007
finished	21:13 44sec Sat 17 Mar 2007
---bss3-21G---
started	16:33 52sec Mon 19 Mar 2007
---bss3-21G---
started	16:36 44sec Mon 19 Mar 2007
---bss3-21G---
started	16:40 51sec Mon 19 Mar 2007
---bss3-21G---
started	16:41 43sec Mon 19 Mar 2007
---bss3-21G---
started	16:42 25sec Mon 19 Mar 2007
finished	16:54 44sec Mon 19 Mar 2007
---vdW_par_bss---
started	17:26 37sec Mon 19 Mar 2007
commencing parameterisation at 17:38 49sec Mon 19 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	17:38 54sec Mon 19 Mar 2007
---vdW_par_bss---
started	17:52 23sec Mon 19 Mar 2007
commencing parameterisation at 18:04 50sec Mon 19 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	18:04 55sec Mon 19 Mar 2007
---vdW_par_bss---
started	18:09 47sec Mon 19 Mar 2007
commencing parameterisation at 18:22 00sec Mon 19 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	18:22 05sec Mon 19 Mar 2007
---steric_par_bss---
started	22:36 16sec Mon 19 Mar 2007
---steric_par_bss---
started	22:37 30sec Mon 19 Mar 2007
commencing parameterisation at 22:37 43sec Mon 19 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	22:37 43sec Mon 19 Mar 2007
---steric_par_bss---
started	22:38 21sec Mon 19 Mar 2007
commencing parameterisation at 22:38 35sec Mon 19 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	22:38 35sec Mon 19 Mar 2007
---steric_par_bss---
started	22:39 01sec Mon 19 Mar 2007
commencing parameterisation at 22:39 15sec Mon 19 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	22:39 15sec Mon 19 Mar 2007
---steric_par_bss---
started	22:46 10sec Mon 19 Mar 2007
commencing parameterisation at 22:46 23sec Mon 19 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	22:46 23sec Mon 19 Mar 2007
---steric_par_bss---
started	22:52 32sec Mon 19 Mar 2007
---steric_par_bss---
started	23:38 53sec Mon 19 Mar 2007
commencing parameterisation at 23:41 17sec Mon 19 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	23:45 33sec Mon 19 Mar 2007
---steric_par_bss---
started	00:16 36sec Tue 20 Mar 2007
commencing parameterisation at 00:18 08sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	00:20 45sec Tue 20 Mar 2007
---steric_par_bss---
started	00:23 58sec Tue 20 Mar 2007
commencing parameterisation at 00:25 21sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	00:27 43sec Tue 20 Mar 2007
---steric_par_bss---
started	01:24 13sec Tue 20 Mar 2007
commencing parameterisation at 01:25 45sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	01:28 09sec Tue 20 Mar 2007
---steric_par_bss---
started	01:28 16sec Tue 20 Mar 2007
commencing parameterisation at 01:29 43sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	01:32 05sec Tue 20 Mar 2007
---steric_par_bss---
started	01:34 54sec Tue 20 Mar 2007
commencing parameterisation at 01:35 49sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	01:35 49sec Tue 20 Mar 2007
---steric_par_bss---
started	01:37 48sec Tue 20 Mar 2007
commencing parameterisation at 01:38 45sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	01:38 45sec Tue 20 Mar 2007
---steric_par_bss---
started	01:38 54sec Tue 20 Mar 2007
commencing parameterisation at 01:39 50sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	01:39 50sec Tue 20 Mar 2007
---vdW_par_bss---
started	01:44 49sec Tue 20 Mar 2007
commencing parameterisation at 01:46 16sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	02:20 32sec Tue 20 Mar 2007
---steric_par_bss---
started	09:10 59sec Tue 20 Mar 2007
commencing parameterisation at 09:11 56sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	09:11 56sec Tue 20 Mar 2007
---steric_par_bss---
started	09:17 57sec Tue 20 Mar 2007
commencing parameterisation at 09:18 53sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	09:18 53sec Tue 20 Mar 2007
---steric_par_bss---
started	09:19 51sec Tue 20 Mar 2007
commencing parameterisation at 09:20 48sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	09:20 48sec Tue 20 Mar 2007
---steric_par_bss---
started	09:20 56sec Tue 20 Mar 2007
commencing parameterisation at 09:21 53sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	09:21 53sec Tue 20 Mar 2007
---steric_par_bss---
started	09:22 00sec Tue 20 Mar 2007
commencing parameterisation at 09:22 55sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	09:22 55sec Tue 20 Mar 2007
---steric_par_bss---
started	09:23 12sec Tue 20 Mar 2007
commencing parameterisation at 09:24 07sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	09:24 07sec Tue 20 Mar 2007
---steric_par_bss---
started	09:24 16sec Tue 20 Mar 2007
commencing parameterisation at 09:25 11sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	09:25 11sec Tue 20 Mar 2007
---steric_par_bss---
started	09:25 36sec Tue 20 Mar 2007
commencing parameterisation at 09:26 30sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	09:26 30sec Tue 20 Mar 2007
---steric_par_bss---
started	09:26 43sec Tue 20 Mar 2007
commencing parameterisation at 09:27 38sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	09:27 38sec Tue 20 Mar 2007
---steric_par_bss---
started	10:05 09sec Tue 20 Mar 2007
commencing parameterisation at 10:06 03sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6
finished	10:06 03sec Tue 20 Mar 2007
---vdW_par_bss---
started	10:29 33sec Tue 20 Mar 2007
commencing parameterisation at 10:30 59sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	11:02 27sec Tue 20 Mar 2007
---vdW_par_bss---
started	12:11 46sec Tue 20 Mar 2007
commencing parameterisation at 12:14 09sec Tue 20 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	13:09 44sec Tue 20 Mar 2007
---par_bss---
started	12:41 32sec Thu 22 Mar 2007
finished	12:43 41sec Thu 22 Mar 2007
---par_bss---
started	12:58 16sec Thu 22 Mar 2007
finished	13:00 23sec Thu 22 Mar 2007
---par_bss---
started	13:02 00sec Thu 22 Mar 2007
finished	13:04 04sec Thu 22 Mar 2007
---bss3-21G---
started	13:05 45sec Thu 22 Mar 2007
finished	13:08 00sec Thu 22 Mar 2007
---par_bss---
started	13:24 23sec Thu 22 Mar 2007
finished	13:26 26sec Thu 22 Mar 2007
---steric_par_bss---
started	22:07 06sec Thu 22 Mar 2007
commencing parameterisation at 22:08 45sec Thu 22 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	22:08 45sec Thu 22 Mar 2007
---steric_par_bss---
started	22:18 36sec Thu 22 Mar 2007
commencing parameterisation at 22:20 16sec Thu 22 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	22:20 16sec Thu 22 Mar 2007
---steric_par_bss---
started	23:21 14sec Thu 22 Mar 2007
---steric_par_bss---
started	23:21 27sec Thu 22 Mar 2007
---steric_par_bss---
started	23:22 22sec Thu 22 Mar 2007
commencing parameterisation at 23:24 01sec Thu 22 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	23:24 01sec Thu 22 Mar 2007
---bss3-21G---
started	00:04 58sec Mon 26 Mar 2007
finished	00:06 22sec Mon 26 Mar 2007
---bss3-21G---
started	00:07 28sec Mon 26 Mar 2007
finished	00:08 51sec Mon 26 Mar 2007
---bss3-21G---
started	00:18 34sec Mon 26 Mar 2007
finished	00:19 59sec Mon 26 Mar 2007
---bss3-21G---
started	00:58 18sec Mon 26 Mar 2007
---bss3-21G---
started	00:58 23sec Mon 26 Mar 2007
---bss3-21G---
started	01:09 28sec Mon 26 Mar 2007
---bss3-21G---
started	00:20 25sec Tue 27 Mar 2007
---bss3-21G---
started	00:21 24sec Tue 27 Mar 2007
finished	00:22 32sec Tue 27 Mar 2007
---bss3-21G---
started	11:02 58sec Tue 27 Mar 2007
finished	11:10 15sec Tue 27 Mar 2007
---bss3-21G---
started	11:17 53sec Tue 27 Mar 2007
finished	11:25 16sec Tue 27 Mar 2007
---bss3-21G---
started	11:35 33sec Tue 27 Mar 2007
finished	11:42 50sec Tue 27 Mar 2007
---bss3-21G---
started	17:17 16sec Tue 27 Mar 2007
---bss3-21G---
started	17:24 00sec Tue 27 Mar 2007
---bss3-21G---
started	17:24 53sec Tue 27 Mar 2007
finished	17:31 51sec Tue 27 Mar 2007
---steric_par_bss---
started	17:41 32sec Tue 27 Mar 2007
---steric_par_bss---
started	17:42 18sec Tue 27 Mar 2007
commencing parameterisation at 17:51 58sec Tue 27 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	18:07 54sec Tue 27 Mar 2007
---steric_par_bss---
started	18:46 38sec Tue 27 Mar 2007
commencing parameterisation at 18:56 14sec Tue 27 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	19:12 25sec Tue 27 Mar 2007
---steric_par_bss---
started	22:16 07sec Tue 27 Mar 2007
commencing parameterisation at 22:25 43sec Tue 27 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	22:42 02sec Tue 27 Mar 2007
---steric_par_bss---
started	23:12 59sec Tue 27 Mar 2007
commencing parameterisation at 23:22 56sec Tue 27 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:39 21sec Tue 27 Mar 2007
---bss3-21G---
started	16:39 28sec Wed 28 Mar 2007
finished	16:46 30sec Wed 28 Mar 2007
---steric_par_bss---
started	18:20 19sec Wed 28 Mar 2007
commencing parameterisation at 18:29 25sec Wed 28 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	18:44 23sec Wed 28 Mar 2007
---steric_par_bss---
started	18:51 23sec Wed 28 Mar 2007
commencing parameterisation at 19:00 40sec Wed 28 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	19:23 14sec Wed 28 Mar 2007
---steric_par_bss---
started	20:12 23sec Wed 28 Mar 2007
commencing parameterisation at 20:21 44sec Wed 28 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	20:39 14sec Wed 28 Mar 2007
commencing parameterisation at 20:48 18sec Wed 28 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	21:10 49sec Wed 28 Mar 2007
---steric_par_bss---
started	21:25 34sec Wed 28 Mar 2007
commencing parameterisation at 21:35 45sec Wed 28 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	22:02 51sec Wed 28 Mar 2007
---steric_par_bss---
started	01:37 11sec Thu 29 Mar 2007
commencing parameterisation at 01:47 23sec Thu 29 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	02:11 47sec Thu 29 Mar 2007
---steric_par_bss---
started	02:30 30sec Thu 29 Mar 2007
commencing parameterisation at 02:40 33sec Thu 29 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	03:04 44sec Thu 29 Mar 2007
---steric_par_bss---
started	18:15 00sec Thu 29 Mar 2007
---steric_par_bss---
started	18:27 11sec Thu 29 Mar 2007
commencing parameterisation at 18:37 05sec Thu 29 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	19:02 56sec Thu 29 Mar 2007
---steric_par_bss---
started	19:29 17sec Thu 29 Mar 2007
commencing parameterisation at 19:38 56sec Thu 29 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	20:13 57sec Thu 29 Mar 2007
---steric_par_bss---
started	18:47 40sec Fri 30 Mar 2007
commencing parameterisation at 18:56 50sec Fri 30 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	19:20 34sec Fri 30 Mar 2007
---steric_par_bss---
started	22:40 27sec Fri 30 Mar 2007
commencing parameterisation at 22:49 44sec Fri 30 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:24 58sec Fri 30 Mar 2007
---steric_par_bss---
started	00:09 18sec Sat 31 Mar 2007
commencing parameterisation at 00:18 25sec Sat 31 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	00:53 27sec Sat 31 Mar 2007
---steric_par_bss---
started	00:57 29sec Sat 31 Mar 2007
commencing parameterisation at 01:06 49sec Sat 31 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	01:42 12sec Sat 31 Mar 2007
---steric_par_bss---
started	02:25 08sec Sat 31 Mar 2007
commencing parameterisation at 02:34 20sec Sat 31 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	03:09 40sec Sat 31 Mar 2007
---steric_par_bss---
started	11:35 17sec Sat 31 Mar 2007
commencing parameterisation at 11:44 30sec Sat 31 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	12:20 06sec Sat 31 Mar 2007
---steric_par_bss---
started	12:35 25sec Sat 31 Mar 2007
commencing parameterisation at 12:44 35sec Sat 31 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	13:20 14sec Sat 31 Mar 2007
---steric_par_bss---
started	13:47 44sec Sat 31 Mar 2007
commencing parameterisation at 13:56 49sec Sat 31 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	14:31 49sec Sat 31 Mar 2007
---steric_par_bss---
started	21:34 16sec Sat 31 Mar 2007
commencing parameterisation at 21:43 44sec Sat 31 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	22:19 03sec Sat 31 Mar 2007
---steric_par_bss---
started	22:28 50sec Sat 31 Mar 2007
commencing parameterisation at 22:38 05sec Sat 31 Mar 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:13 44sec Sat 31 Mar 2007
---steric_par_bss---
started	23:53 33sec Sat 31 Mar 2007
commencing parameterisation at 23:53 44sec Sat 31 Mar 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	23:53 44sec Sat 31 Mar 2007
---steric_par_bss---
started	23:56 41sec Sat 31 Mar 2007
---steric_par_bss---
started	00:01 49sec Sun 1 Apr 2007
commencing parameterisation at 00:02 01sec Sun 1 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	00:02 01sec Sun 1 Apr 2007
---steric_par_bss---
started	00:43 55sec Sun 1 Apr 2007
commencing parameterisation at 00:44 10sec Sun 1 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	00:44 10sec Sun 1 Apr 2007
---steric_par_bss---
started	22:04 14sec Sun 1 Apr 2007
commencing parameterisation at 22:04 37sec Sun 1 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	22:04 37sec Sun 1 Apr 2007
---par_bss---
started	12:31 34sec Mon 2 Apr 2007
finished	12:31 47sec Mon 2 Apr 2007
---par_bss---
started	12:38 32sec Mon 2 Apr 2007
finished	12:38 42sec Mon 2 Apr 2007
---par_bss---
started	12:42 39sec Mon 2 Apr 2007
finished	12:42 52sec Mon 2 Apr 2007
---par_bss---
started	12:43 41sec Mon 2 Apr 2007
finished	12:43 51sec Mon 2 Apr 2007
---par_bss---
started	12:46 12sec Mon 2 Apr 2007
finished	12:46 22sec Mon 2 Apr 2007
---steric_par_bss---
started	19:05 25sec Mon 2 Apr 2007
commencing parameterisation at 19:05 42sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	19:05 42sec Mon 2 Apr 2007
---steric_par_bss---
started	19:06 27sec Mon 2 Apr 2007
commencing parameterisation at 19:06 43sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	19:06 43sec Mon 2 Apr 2007
---steric_par_bss---
started	19:07 03sec Mon 2 Apr 2007
commencing parameterisation at 19:07 38sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	19:07 38sec Mon 2 Apr 2007
---steric_par_bss---
started	19:19 21sec Mon 2 Apr 2007
commencing parameterisation at 19:19 49sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	19:19 49sec Mon 2 Apr 2007
---steric_par_bss---
started	19:20 27sec Mon 2 Apr 2007
---steric_par_bss---
started	19:21 23sec Mon 2 Apr 2007
---steric_par_bss---
started	19:22 14sec Mon 2 Apr 2007
commencing parameterisation at 19:22 42sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	19:22 42sec Mon 2 Apr 2007
---steric_par_bss---
started	19:31 18sec Mon 2 Apr 2007
commencing parameterisation at 19:31 44sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	19:31 44sec Mon 2 Apr 2007
---steric_par_bss---
started	19:36 20sec Mon 2 Apr 2007
commencing parameterisation at 19:36 38sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	19:36 38sec Mon 2 Apr 2007
---steric_par_bss---
started	19:43 18sec Mon 2 Apr 2007
commencing parameterisation at 19:43 45sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	19:43 45sec Mon 2 Apr 2007
---steric_par_bss---
started	20:29 23sec Mon 2 Apr 2007
commencing parameterisation at 20:29 46sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	20:29 46sec Mon 2 Apr 2007
---steric_par_bss---
started	20:32 09sec Mon 2 Apr 2007
commencing parameterisation at 20:32 27sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	20:32 27sec Mon 2 Apr 2007
---steric_par_bss---
started	20:32 41sec Mon 2 Apr 2007
commencing parameterisation at 20:33 04sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	20:33 04sec Mon 2 Apr 2007
---steric_par_bss---
started	20:38 48sec Mon 2 Apr 2007
commencing parameterisation at 20:39 03sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	20:39 04sec Mon 2 Apr 2007
---steric_par_bss---
started	20:42 48sec Mon 2 Apr 2007
commencing parameterisation at 20:43 04sec Mon 2 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	20:43 04sec Mon 2 Apr 2007
---bss3-21G---
started	01:04 52sec Tue 3 Apr 2007
finished	01:16 21sec Tue 3 Apr 2007
---steric_par_bss---
started	02:06 54sec Tue 3 Apr 2007
---steric_par_bss---
started	02:07 58sec Tue 3 Apr 2007
commencing parameterisation at 02:17 33sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	02:50 29sec Tue 3 Apr 2007
---steric_par_bss---
started	11:28 44sec Tue 3 Apr 2007
commencing parameterisation at 11:38 04sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	12:13 27sec Tue 3 Apr 2007
---steric_par_bss---
started	12:39 53sec Tue 3 Apr 2007
commencing parameterisation at 12:49 32sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	13:22 32sec Tue 3 Apr 2007
---steric_par_bss---
started	13:35 02sec Tue 3 Apr 2007
---steric_par_bss---
started	13:35 35sec Tue 3 Apr 2007
commencing parameterisation at 13:45 21sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	14:20 21sec Tue 3 Apr 2007
---steric_par_bss---
started	14:48 42sec Tue 3 Apr 2007
commencing parameterisation at 14:49 02sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	14:49 02sec Tue 3 Apr 2007
---steric_par_bss---
started	15:08 41sec Tue 3 Apr 2007
commencing parameterisation at 15:17 57sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	15:51 21sec Tue 3 Apr 2007
---steric_par_bss---
started	15:58 39sec Tue 3 Apr 2007
commencing parameterisation at 15:58 50sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:58 50sec Tue 3 Apr 2007
---steric_par_bss---
started	16:00 20sec Tue 3 Apr 2007
commencing parameterisation at 16:00 32sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:00 32sec Tue 3 Apr 2007
---bss3-21G---
started	16:05 17sec Tue 3 Apr 2007
finished	16:05 29sec Tue 3 Apr 2007
---steric_par_bss---
started	16:06 56sec Tue 3 Apr 2007
commencing parameterisation at 16:07 07sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:07 07sec Tue 3 Apr 2007
---steric_par_bss---
started	16:11 40sec Tue 3 Apr 2007
commencing parameterisation at 16:11 52sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:11 52sec Tue 3 Apr 2007
---steric_par_bss---
started	16:15 41sec Tue 3 Apr 2007
---steric_par_bss---
started	16:16 15sec Tue 3 Apr 2007
commencing parameterisation at 16:16 26sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:16 26sec Tue 3 Apr 2007
---steric_par_bss---
started	16:20 57sec Tue 3 Apr 2007
commencing parameterisation at 16:21 08sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:21 08sec Tue 3 Apr 2007
---steric_par_bss---
started	16:44 20sec Tue 3 Apr 2007
commencing parameterisation at 16:44 31sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:44 31sec Tue 3 Apr 2007
---steric_par_bss---
started	16:45 42sec Tue 3 Apr 2007
---steric_par_bss---
started	16:46 13sec Tue 3 Apr 2007
commencing parameterisation at 16:55 20sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	17:26 19sec Tue 3 Apr 2007
---steric_par_bss---
started	18:33 21sec Tue 3 Apr 2007
commencing parameterisation at 18:43 14sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	19:20 58sec Tue 3 Apr 2007
---steric_par_bss---
started	19:38 04sec Tue 3 Apr 2007
commencing parameterisation at 19:47 53sec Tue 3 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	20:25 06sec Tue 3 Apr 2007
---vdW_par_bss---
started	12:57 50sec Wed 4 Apr 2007
---vdW_par_bss---
started	12:59 53sec Wed 4 Apr 2007
---vdW_par_bss---
started	13:00 57sec Wed 4 Apr 2007
commencing parameterisation at 13:01 48sec Wed 4 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	13:13 38sec Wed 4 Apr 2007
---vdW_par_bss---
started	13:23 29sec Wed 4 Apr 2007
commencing parameterisation at 13:24 32sec Wed 4 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	13:39 37sec Wed 4 Apr 2007
---vdW_par_bss---
started	16:42 43sec Wed 4 Apr 2007
commencing parameterisation at 16:43 46sec Wed 4 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
3	4	5	6	7	8	9	10	11	12
finished	16:56 11sec Wed 4 Apr 2007
---bss3-21G---
started	00:37 15sec Thu 5 Apr 2007
---bss3-21G---
started	00:47 48sec Thu 5 Apr 2007
finished	00:59 23sec Thu 5 Apr 2007
---bss3-21G---
started	01:16 06sec Thu 5 Apr 2007
finished	01:25 53sec Thu 5 Apr 2007
---vdW_par_bss---
started	02:31 15sec Thu 5 Apr 2007
commencing parameterisation at 02:43 51sec Thu 5 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	02:43 56sec Thu 5 Apr 2007
---vdW_par_bss---
started	02:47 53sec Thu 5 Apr 2007
commencing parameterisation at 03:00 28sec Thu 5 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---vdW_par_bss---
started	03:03 19sec Thu 5 Apr 2007
commencing parameterisation at 03:04 51sec Thu 5 Apr 2007.
The following steric interactions will be parameterised
HH H6-H6	HO H6-O6	HO H6-O7
The following hardness parameters are tested.
6	12
finished	03:04 51sec Thu 5 Apr 2007
---vdW_par_bss---
started	03:14 59sec Thu 5 Apr 2007
commencing parameterisation at 03:27 42sec Thu 5 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---bss3-21G---
started	03:33 14sec Thu 5 Apr 2007
finished	03:42 48sec Thu 5 Apr 2007
---vdW_par_bss---
started	03:48 26sec Thu 5 Apr 2007
commencing parameterisation at 04:00 50sec Thu 5 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	04:00 55sec Thu 5 Apr 2007
---steric_par_bss---
started	01:23 26sec Sun 29 Apr 2007
---steric_par_bss---
started	01:31 13sec Sun 29 Apr 2007
commencing parameterisation at 01:41 03sec Sun 29 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	01:41 07sec Sun 29 Apr 2007
---steric_par_bss---
started	01:43 25sec Sun 29 Apr 2007
commencing parameterisation at 01:53 12sec Sun 29 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	01:54 43sec Sun 29 Apr 2007
---steric_par_bss---
started	02:01 04sec Sun 29 Apr 2007
commencing parameterisation at 02:11 36sec Sun 29 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	02:13 03sec Sun 29 Apr 2007
---steric_par_bss---
started	02:15 52sec Sun 29 Apr 2007
commencing parameterisation at 02:26 09sec Sun 29 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	02:27 31sec Sun 29 Apr 2007
---steric_par_bss---
started	02:29 22sec Sun 29 Apr 2007
commencing parameterisation at 02:39 18sec Sun 29 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	02:40 33sec Sun 29 Apr 2007
---steric_par_bss---
started	02:59 19sec Sun 29 Apr 2007
commencing parameterisation at 03:09 14sec Sun 29 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	03:43 11sec Sun 29 Apr 2007
---steric_par_bss---
started	20:32 08sec Sun 29 Apr 2007
commencing parameterisation at 20:41 28sec Sun 29 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	20:42 37sec Sun 29 Apr 2007
---steric_par_bss---
started	21:23 51sec Sun 29 Apr 2007
commencing parameterisation at 21:33 01sec Sun 29 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	21:34 10sec Sun 29 Apr 2007
---steric_par_bss---
started	22:58 36sec Sun 29 Apr 2007
commencing parameterisation at 23:08 03sec Sun 29 Apr 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:32 21sec Sun 29 Apr 2007
---bss3-21G---
started	14:02 13sec Tue 1 May 2007
finished	14:03 19sec Tue 1 May 2007
---bss3-21G---
started	14:05 31sec Tue 1 May 2007
finished	14:06 38sec Tue 1 May 2007
---bss3-21G---
started	15:10 18sec Tue 1 May 2007
finished	15:11 28sec Tue 1 May 2007
---bss3-21G---
started	15:14 39sec Tue 1 May 2007
finished	15:15 47sec Tue 1 May 2007
---bss3-21G---
started	15:16 55sec Tue 1 May 2007
finished	15:18 00sec Tue 1 May 2007
---bss3-21G---
started	15:19 33sec Tue 1 May 2007
finished	15:20 39sec Tue 1 May 2007
---bss3-21G---
started	15:23 28sec Tue 1 May 2007
finished	15:24 33sec Tue 1 May 2007
---bss3-21G---
started	22:41 34sec Wed 2 May 2007
finished	22:42 16sec Wed 2 May 2007
---bss3-21G---
started	22:45 29sec Wed 2 May 2007
finished	22:46 11sec Wed 2 May 2007
---bss3-21G---
started	22:48 08sec Wed 2 May 2007
---bss3-21G---
started	22:51 09sec Wed 2 May 2007
finished	22:52 04sec Wed 2 May 2007
---bss3-21G---
started	23:23 07sec Wed 2 May 2007
---bss3-21G---
started	16:50 12sec Sat 21 Jul 2007
finished	16:50 14sec Sat 21 Jul 2007
---bss3-21G---
started	17:04 31sec Sat 21 Jul 2007
finished	17:04 32sec Sat 21 Jul 2007
---bss3-21G---
started	17:07 01sec Sat 21 Jul 2007
---bss3-21G---
started	17:07 55sec Sat 21 Jul 2007
finished	17:08 04sec Sat 21 Jul 2007
---bss3-21G---
started	17:10 29sec Sat 21 Jul 2007
finished	17:10 33sec Sat 21 Jul 2007
---bss3-21G---
started	18:06 42sec Sat 28 Jul 2007
finished	18:06 43sec Sat 28 Jul 2007
---bss3-21G---
started	00:28 45sec Thu 2 Aug 2007
finished	00:29 49sec Thu 2 Aug 2007
---bss3-21G---
started	13:00 17sec Thu 2 Aug 2007
---bss3-21G---
started	13:03 04sec Thu 2 Aug 2007
---bss3-21G---
started	13:07 12sec Thu 2 Aug 2007
---bss3-21G---
started	13:08 25sec Thu 2 Aug 2007
---bss3-21G---
started	13:09 51sec Thu 2 Aug 2007
---bss3-21G---
started	13:10 53sec Thu 2 Aug 2007
finished	13:11 38sec Thu 2 Aug 2007
---bss3-21G---
started	13:13 22sec Thu 2 Aug 2007
---bss3-21G---
started	13:30 33sec Thu 2 Aug 2007
---bss3-21G---
started	13:42 39sec Thu 2 Aug 2007
---bss3-21G---
started	13:42 58sec Thu 2 Aug 2007
---bss3-21G---
started	13:47 04sec Thu 2 Aug 2007
---bss3-21G---
started	13:57 13sec Thu 2 Aug 2007
---bss3-21G---
started	14:00 13sec Thu 2 Aug 2007
---bss3-21G---
started	14:01 43sec Thu 2 Aug 2007
finished	14:01 49sec Thu 2 Aug 2007
---bss3-21G---
started	19:15 57sec Thu 2 Aug 2007
finished	19:17 00sec Thu 2 Aug 2007
---bss3-21G---
started	19:19 16sec Thu 2 Aug 2007
finished	19:20 22sec Thu 2 Aug 2007
---bss3-21G---
started	19:26 43sec Thu 2 Aug 2007
finished	19:27 48sec Thu 2 Aug 2007
---bss3-21G---
started	20:47 56sec Thu 2 Aug 2007
finished	20:48 59sec Thu 2 Aug 2007
---bss3-21G---
started	23:49 31sec Thu 2 Aug 2007
finished	23:51 51sec Thu 2 Aug 2007
---bss3-21G---
started	23:58 00sec Thu 2 Aug 2007
finished	23:59 06sec Thu 2 Aug 2007
---bss3-21G---
started	00:07 56sec Sat 4 Aug 2007
finished	00:09 03sec Sat 4 Aug 2007
---bss3-21G---
started	00:10 56sec Sat 4 Aug 2007
finished	00:12 01sec Sat 4 Aug 2007
---bss3-21G---
started	00:14 03sec Sat 4 Aug 2007
finished	00:15 10sec Sat 4 Aug 2007
---bss3-21G---
started	00:16 31sec Sat 4 Aug 2007
finished	00:17 37sec Sat 4 Aug 2007
---bss3-21G---
started	00:26 30sec Sat 4 Aug 2007
finished	00:27 34sec Sat 4 Aug 2007
---bss3-21G---
started	00:40 15sec Sat 4 Aug 2007
---bss3-21G---
started	00:40 44sec Sat 4 Aug 2007
finished	00:41 39sec Sat 4 Aug 2007
---bss3-21G---
started	00:49 37sec Sat 4 Aug 2007
finished	00:50 34sec Sat 4 Aug 2007
---bss3-21G---
started	22:31 32sec Sat 4 Aug 2007
finished	22:32 40sec Sat 4 Aug 2007
---bss3-21G---
started	00:13 53sec Sun 5 Aug 2007
finished	00:15 00sec Sun 5 Aug 2007
---bss3-21G---
started	00:20 04sec Sun 5 Aug 2007
finished	00:21 11sec Sun 5 Aug 2007
---bss3-21G---
started	00:55 14sec Sun 5 Aug 2007
finished	00:56 14sec Sun 5 Aug 2007
---bss3-21G---
started	01:02 56sec Sun 5 Aug 2007
finished	01:02 58sec Sun 5 Aug 2007
---bss3-21G---
started	01:04 37sec Sun 5 Aug 2007
finished	01:05 38sec Sun 5 Aug 2007
---bss3-21G---
started	01:10 40sec Sun 5 Aug 2007
finished	01:11 38sec Sun 5 Aug 2007
---bss3-21G---
started	19:56 33sec Tue 7 Aug 2007
finished	19:57 32sec Tue 7 Aug 2007
---bss3-21G---
started	19:58 13sec Tue 7 Aug 2007
finished	19:59 10sec Tue 7 Aug 2007
---bss3-21G---
started	20:11 02sec Tue 7 Aug 2007
finished	20:12 00sec Tue 7 Aug 2007
---bss3-21G---
started	20:14 06sec Tue 7 Aug 2007
finished	20:15 01sec Tue 7 Aug 2007
---bss3-21G---
started	20:35 25sec Tue 7 Aug 2007
finished	20:36 21sec Tue 7 Aug 2007
---bss3-21G---
started	20:45 29sec Tue 7 Aug 2007
finished	20:46 26sec Tue 7 Aug 2007
---bss3-21G---
started	21:05 32sec Tue 7 Aug 2007
finished	21:06 29sec Tue 7 Aug 2007
---bss3-21G---
started	21:37 53sec Tue 7 Aug 2007
finished	21:39 01sec Tue 7 Aug 2007
---bss3-21G---
started	21:48 11sec Tue 7 Aug 2007
finished	21:49 17sec Tue 7 Aug 2007
---steric_par_bss---
started	15:29 49sec Tue 14 Aug 2007
---steric_par_bss---
started	15:30 08sec Tue 14 Aug 2007
commencing parameterisation at 15:31 17sec Tue 14 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:31 17sec Tue 14 Aug 2007
---steric_par_bss---
started	15:46 48sec Tue 14 Aug 2007
---steric_par_bss---
started	15:48 51sec Tue 14 Aug 2007
---steric_par_bss---
started	15:49 49sec Tue 14 Aug 2007
---steric_par_bss---
started	15:52 56sec Tue 14 Aug 2007
commencing parameterisation at 16:02 14sec Tue 14 Aug 2007.
The following steric interactions will be parameterised
HH H16-H6	HH H6-H6	HH H6-H7	HH H6-H8
The following hardness parameters are tested.
6	12
finished	16:02 24sec Tue 14 Aug 2007
---steric_par_bss---
started	16:33 25sec Tue 14 Aug 2007
commencing parameterisation at 16:43 24sec Tue 14 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	17:08 49sec Tue 14 Aug 2007
---steric_par_bss---
started	17:18 15sec Tue 14 Aug 2007
commencing parameterisation at 17:28 23sec Tue 14 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6
The following hardness parameters are tested.
6	12
finished	17:28 27sec Tue 14 Aug 2007
---steric_par_bss---
started	18:19 38sec Tue 14 Aug 2007
commencing parameterisation at 18:29 55sec Tue 14 Aug 2007.
The following steric interactions will be parameterised
HH H16-H6	HH H6-H6	HH H6-H7	HH H6-H8	HN H6-N61	HN H6-N8	HN H6-N9	HO H6-O6	HO H6-O7	HO H7-O7	HO H8-O7	NN N61-N61	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6
finished	18:29 58sec Tue 14 Aug 2007
---steric_par_bss---
started	23:21 11sec Tue 14 Aug 2007
---steric_par_bss---
started	23:21 58sec Tue 14 Aug 2007
commencing parameterisation at 23:23 11sec Tue 14 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6	HN H6-N8	HO H6-O6	HO H6-O7	NN N8-N8	NO N8-O6	NO N8-O7	OO O6-O6	OO O6-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:23 21sec Tue 14 Aug 2007
---steric_par_bss---
started	23:24 13sec Tue 14 Aug 2007
commencing parameterisation at 23:33 46sec Tue 14 Aug 2007.
The following steric interactions will be parameterised
HH H16-H6	HH H6-H6	HH H6-H7	HH H6-H8	HN H6-N61	HN H6-N8	HN H6-N9	HO H6-O6	HO H6-O7	HO H7-O7	HO H8-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	23:35 10sec Tue 14 Aug 2007
commencing parameterisation at 23:44 14sec Tue 14 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	00:07 00sec Wed 15 Aug 2007
---steric_par_bss---
started	00:16 04sec Wed 15 Aug 2007
commencing parameterisation at 00:18 53sec Wed 15 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	00:18 53sec Wed 15 Aug 2007
---steric_par_bss---
started	00:24 16sec Wed 15 Aug 2007
commencing parameterisation at 00:27 08sec Wed 15 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	00:27 08sec Wed 15 Aug 2007
---steric_par_bss---
started	00:29 22sec Wed 15 Aug 2007
---steric_par_bss---
started	00:30 25sec Wed 15 Aug 2007
commencing parameterisation at 00:33 13sec Wed 15 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	00:33 13sec Wed 15 Aug 2007
---bss3-21G---
started	22:13 04sec Wed 15 Aug 2007
---bss3-21G---
started	22:14 24sec Wed 15 Aug 2007
finished	22:21 52sec Wed 15 Aug 2007
---steric_par_bss---
started	22:26 05sec Wed 15 Aug 2007
aborted	22:36 08sec Wed 15 Aug 2007
---steric_par_bss---
started	22:40 53sec Wed 15 Aug 2007
commencing parameterisation at 22:50 44sec Wed 15 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:15 36sec Wed 15 Aug 2007
---steric_par_bss---
started	23:32 55sec Wed 15 Aug 2007
commencing parameterisation at 23:34 12sec Wed 15 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	23:34 12sec Wed 15 Aug 2007
---steric_par_bss---
started	23:35 17sec Wed 15 Aug 2007
commencing parameterisation at 23:38 24sec Wed 15 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	23:38 24sec Wed 15 Aug 2007
---steric_par_bss---
started	23:52 39sec Wed 15 Aug 2007
commencing parameterisation at 23:55 44sec Wed 15 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	23:55 44sec Wed 15 Aug 2007
---steric_par_bss---
started	23:57 06sec Wed 15 Aug 2007
commencing parameterisation at 00:00 03sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	00:00 03sec Thu 16 Aug 2007
---steric_par_bss---
started	00:08 00sec Thu 16 Aug 2007
commencing parameterisation at 00:11 01sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	00:11 01sec Thu 16 Aug 2007
---steric_par_bss---
started	00:15 09sec Thu 16 Aug 2007
---steric_par_bss---
started	00:16 43sec Thu 16 Aug 2007
commencing parameterisation at 00:26 22sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---bss3-21G---
started	00:28 39sec Thu 16 Aug 2007
---bss3-21G---
started	00:30 50sec Thu 16 Aug 2007
finished	00:40 16sec Thu 16 Aug 2007
---steric_par_bss---
started	00:41 31sec Thu 16 Aug 2007
---steric_par_bss---
started	00:41 51sec Thu 16 Aug 2007
commencing parameterisation at 00:51 35sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	01:16 21sec Thu 16 Aug 2007
---steric_par_bss---
started	01:45 19sec Thu 16 Aug 2007
commencing parameterisation at 01:54 35sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	02:17 33sec Thu 16 Aug 2007
---steric_par_bss---
started	10:00 43sec Thu 16 Aug 2007
---steric_par_bss---
started	10:01 14sec Thu 16 Aug 2007
commencing parameterisation at 10:10 32sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	10:33 06sec Thu 16 Aug 2007
---steric_par_bss---
started	10:35 02sec Thu 16 Aug 2007
commencing parameterisation at 10:44 13sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	11:06 45sec Thu 16 Aug 2007
---steric_par_bss---
started	16:11 52sec Thu 16 Aug 2007
commencing parameterisation at 16:21 21sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	16:44 11sec Thu 16 Aug 2007
---steric_par_bss---
started	17:11 59sec Thu 16 Aug 2007
commencing parameterisation at 17:21 05sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6
finished	17:21 07sec Thu 16 Aug 2007
---steric_par_bss---
started	23:09 59sec Thu 16 Aug 2007
---steric_par_bss---
started	23:12 36sec Thu 16 Aug 2007
commencing parameterisation at 23:13 26sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N8	HO H21-O7	HO H6-O7	OO O7-O7
The following hardness parameters are tested.
6
finished	23:13 26sec Thu 16 Aug 2007
---steric_par_bss---
started	23:14 33sec Thu 16 Aug 2007
commencing parameterisation at 23:15 27sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6
finished	23:15 27sec Thu 16 Aug 2007
---steric_par_bss---
started	23:17 25sec Thu 16 Aug 2007
commencing parameterisation at 23:19 14sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6
finished	23:19 14sec Thu 16 Aug 2007
---steric_par_bss---
started	23:23 36sec Thu 16 Aug 2007
commencing parameterisation at 23:32 44sec Thu 16 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6
finished	23:32 46sec Thu 16 Aug 2007
---vdW_par_bss---
started	23:36 18sec Thu 16 Aug 2007
aborted	23:48 02sec Thu 16 Aug 2007
---vdW_par_bss---
started	23:53 32sec Thu 16 Aug 2007
---vdW_par_bss---
started	23:54 27sec Thu 16 Aug 2007
commencing parameterisation at 00:06 15sec Fri 17 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	00:06 20sec Fri 17 Aug 2007
---steric_par_bss---
started	00:18 54sec Fri 17 Aug 2007
commencing parameterisation at 00:27 52sec Fri 17 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6
finished	00:27 54sec Fri 17 Aug 2007
---steric_par_bss---
started	00:34 33sec Fri 17 Aug 2007
commencing parameterisation at 00:43 46sec Fri 17 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	01:06 41sec Fri 17 Aug 2007
---bss3-21G---
started	02:12 34sec Fri 17 Aug 2007
---bss3-21G---
started	02:14 32sec Fri 17 Aug 2007
---steric_par_bss---
started	15:19 49sec Fri 17 Aug 2007
---steric_par_bss---
started	15:21 30sec Fri 17 Aug 2007
commencing parameterisation at 15:30 38sec Fri 17 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	15:55 30sec Fri 17 Aug 2007
---steric_par_bss---
started	18:13 20sec Fri 17 Aug 2007
commencing parameterisation at 18:22 45sec Fri 17 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	18:45 05sec Fri 17 Aug 2007
---steric_par_bss---
started	18:51 23sec Fri 17 Aug 2007
commencing parameterisation at 19:00 47sec Fri 17 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	19:23 43sec Fri 17 Aug 2007
---steric_par_bss---
started	20:21 01sec Fri 17 Aug 2007
commencing parameterisation at 20:30 09sec Fri 17 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	20:52 59sec Fri 17 Aug 2007
---steric_par_bss---
started	21:44 49sec Fri 17 Aug 2007
commencing parameterisation at 21:53 58sec Fri 17 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	22:15 51sec Fri 17 Aug 2007
---steric_par_bss---
started	23:25 41sec Fri 17 Aug 2007
commencing parameterisation at 23:34 48sec Fri 17 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:56 37sec Fri 17 Aug 2007
---bss3-21G---
started	02:03 52sec Sat 18 Aug 2007
finished	02:03 57sec Sat 18 Aug 2007
---steric_par_bss---
started	02:25 37sec Sat 18 Aug 2007
commencing parameterisation at 02:34 43sec Sat 18 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	03:03 47sec Sat 18 Aug 2007
---bss3-21G---
started	11:53 10sec Sat 18 Aug 2007
finished	11:53 14sec Sat 18 Aug 2007
---bss3-21G---
started	11:55 11sec Sat 18 Aug 2007
finished	11:55 16sec Sat 18 Aug 2007
---bss3-21G---
started	11:57 31sec Sat 18 Aug 2007
finished	11:57 35sec Sat 18 Aug 2007
---bss3-21G---
started	12:34 30sec Sat 18 Aug 2007
finished	12:34 34sec Sat 18 Aug 2007
---bss3-21G---
started	12:52 25sec Sat 18 Aug 2007
finished	12:52 30sec Sat 18 Aug 2007
---steric_par_bss---
started	13:21 54sec Sat 18 Aug 2007
---steric_par_bss---
started	13:22 31sec Sat 18 Aug 2007
commencing parameterisation at 13:31 36sec Sat 18 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	14:00 32sec Sat 18 Aug 2007
---steric_par_bss---
started	00:27 21sec Mon 20 Aug 2007
commencing parameterisation at 00:27 33sec Mon 20 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	00:27 33sec Mon 20 Aug 2007
---steric_par_bss---
started	00:30 43sec Mon 20 Aug 2007
commencing parameterisation at 00:31 02sec Mon 20 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	00:31 02sec Mon 20 Aug 2007
---steric_par_bss---
started	00:32 34sec Mon 20 Aug 2007
commencing parameterisation at 00:32 51sec Mon 20 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12	13	14	15	16	17	18	19	20	21	22	23	24
finished	00:32 51sec Mon 20 Aug 2007
---vdW_par_bss---
started	23:29 31sec Tue 21 Aug 2007
commencing parameterisation at 23:41 58sec Tue 21 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:42 03sec Tue 21 Aug 2007
---vdW_par_bss---
started	00:04 50sec Wed 22 Aug 2007
commencing parameterisation at 00:17 03sec Wed 22 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	00:17 07sec Wed 22 Aug 2007
---vdW_par_bss---
started	01:02 01sec Wed 22 Aug 2007
commencing parameterisation at 01:14 47sec Wed 22 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	01:14 52sec Wed 22 Aug 2007
---bss3-21G---
started	13:21 51sec Fri 24 Aug 2007
finished	13:21 56sec Fri 24 Aug 2007
---steric_par_bss---
started	16:58 44sec Fri 24 Aug 2007
commencing parameterisation at 17:08 00sec Fri 24 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	17:30 02sec Fri 24 Aug 2007
---bss3-21G---
started	18:22 13sec Fri 24 Aug 2007
finished	18:22 17sec Fri 24 Aug 2007
---steric_par_bss---
started	19:18 35sec Fri 24 Aug 2007
commencing parameterisation at 19:27 44sec Fri 24 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	19:56 33sec Fri 24 Aug 2007
---steric_par_bss---
started	21:39 00sec Fri 24 Aug 2007
commencing parameterisation at 21:53 29sec Fri 24 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	21:56 58sec Fri 24 Aug 2007
commencing parameterisation at 22:06 01sec Fri 24 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	22:39 31sec Fri 24 Aug 2007
---steric_par_bss---
started	22:50 17sec Fri 24 Aug 2007
commencing parameterisation at 22:59 32sec Fri 24 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:32 45sec Fri 24 Aug 2007
---steric_tot_en---
started	23:03 16sec Sun 26 Aug 2007
---steric_tot_en---
started	23:03 49sec Sun 26 Aug 2007
commencing parameterisation at 23:04 50sec Sun 26 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
5
finished	23:04 50sec Sun 26 Aug 2007
---steric_tot_en---
started	23:53 24sec Sun 26 Aug 2007
---steric_tot_en---
started	23:54 04sec Sun 26 Aug 2007
commencing parameterisation at 23:55 11sec Sun 26 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
5
finished	23:55 11sec Sun 26 Aug 2007
---steric_tot_en---
started	00:48 31sec Mon 27 Aug 2007
commencing parameterisation at 00:49 37sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
5
finished	00:49 37sec Mon 27 Aug 2007
---steric_tot_en---
started	00:55 41sec Mon 27 Aug 2007
---steric_tot_en---
started	00:56 33sec Mon 27 Aug 2007
---steric_tot_en---
started	00:58 07sec Mon 27 Aug 2007
commencing parameterisation at 00:59 13sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
5
finished	00:59 13sec Mon 27 Aug 2007
---steric_tot_en---
started	01:01 20sec Mon 27 Aug 2007
commencing parameterisation at 01:02 25sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
5
finished	01:02 25sec Mon 27 Aug 2007
---steric_tot_en---
started	01:10 24sec Mon 27 Aug 2007
commencing parameterisation at 01:11 28sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
5
finished	01:11 28sec Mon 27 Aug 2007
---steric_tot_en---
started	01:14 07sec Mon 27 Aug 2007
commencing parameterisation at 01:15 15sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
5
finished	01:15 15sec Mon 27 Aug 2007
---steric_tot_en---
started	01:16 54sec Mon 27 Aug 2007
commencing parameterisation at 01:17 58sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
5
finished	01:17 58sec Mon 27 Aug 2007
---steric_tot_en---
started	01:20 12sec Mon 27 Aug 2007
commencing parameterisation at 01:21 15sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
5
finished	01:21 15sec Mon 27 Aug 2007
---steric_tot_en---
started	01:23 15sec Mon 27 Aug 2007
commencing parameterisation at 01:32 15sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
5
finished	01:32 18sec Mon 27 Aug 2007
---steric_tot_en---
started	11:15 51sec Mon 27 Aug 2007
---steric_tot_en---
started	12:06 31sec Mon 27 Aug 2007
commencing parameterisation at 12:16 21sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	12:39 21sec Mon 27 Aug 2007
---steric_tot_en---
started	13:00 25sec Mon 27 Aug 2007
commencing parameterisation at 13:02 54sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12
finished	13:02 54sec Mon 27 Aug 2007
---steric_tot_en---
started	13:44 58sec Mon 27 Aug 2007
---steric_tot_en---
started	13:46 10sec Mon 27 Aug 2007
---steric_tot_en---
started	13:48 05sec Mon 27 Aug 2007
commencing parameterisation at 13:50 18sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12
finished	13:50 33sec Mon 27 Aug 2007
---vdW_par_bss---
started	14:06 18sec Mon 27 Aug 2007
commencing parameterisation at 14:08 46sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	14:08 46sec Mon 27 Aug 2007
---vdW_par_bss---
started	14:43 23sec Mon 27 Aug 2007
---steric_tot_en---
started	14:44 02sec Mon 27 Aug 2007
---steric_tot_en---
started	14:44 59sec Mon 27 Aug 2007
commencing parameterisation at 14:46 48sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6
finished	14:46 49sec Mon 27 Aug 2007
---steric_tot_en---
started	14:55 54sec Mon 27 Aug 2007
commencing parameterisation at 14:57 39sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6
finished	14:57 39sec Mon 27 Aug 2007
---steric_tot_en---
started	15:21 18sec Mon 27 Aug 2007
commencing parameterisation at 15:23 03sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6
finished	15:23 03sec Mon 27 Aug 2007
---steric_tot_en---
started	15:29 53sec Mon 27 Aug 2007
commencing parameterisation at 15:31 37sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6
finished	15:31 37sec Mon 27 Aug 2007
---steric_tot_en---
started	15:36 25sec Mon 27 Aug 2007
commencing parameterisation at 15:38 15sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6
finished	15:38 15sec Mon 27 Aug 2007
---steric_tot_en---
started	15:40 52sec Mon 27 Aug 2007
commencing parameterisation at 15:42 37sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6
finished	15:42 37sec Mon 27 Aug 2007
---steric_tot_en---
started	15:54 23sec Mon 27 Aug 2007
commencing parameterisation at 15:56 10sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	15:56 10sec Mon 27 Aug 2007
---steric_par_bss---
started	19:05 50sec Mon 27 Aug 2007
commencing parameterisation at 19:06 05sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	19:06 05sec Mon 27 Aug 2007
---steric_par_bss---
started	19:20 36sec Mon 27 Aug 2007
commencing parameterisation at 19:20 52sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12
finished	19:20 52sec Mon 27 Aug 2007
---steric_par_bss---
started	19:29 44sec Mon 27 Aug 2007
commencing parameterisation at 19:29 57sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12
finished	19:29 57sec Mon 27 Aug 2007
---steric_par_bss---
started	19:30 54sec Mon 27 Aug 2007
commencing parameterisation at 19:31 08sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12
finished	19:31 08sec Mon 27 Aug 2007
---steric_par_bss---
started	19:34 35sec Mon 27 Aug 2007
commencing parameterisation at 19:34 48sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12
finished	19:34 48sec Mon 27 Aug 2007
---steric_par_bss---
started	19:36 18sec Mon 27 Aug 2007
commencing parameterisation at 19:36 31sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12
finished	19:36 31sec Mon 27 Aug 2007
---vdW_par_bss---
started	20:18 53sec Mon 27 Aug 2007
commencing parameterisation at 20:30 46sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	20:30 50sec Mon 27 Aug 2007
---vdW_par_bss---
started	20:35 54sec Mon 27 Aug 2007
commencing parameterisation at 20:47 58sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	20:48 03sec Mon 27 Aug 2007
---vdW_par_bss---
started	20:49 15sec Mon 27 Aug 2007
commencing parameterisation at 21:01 16sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	21:01 22sec Mon 27 Aug 2007
---vdW_par_bss---
started	21:11 58sec Mon 27 Aug 2007
commencing parameterisation at 21:23 54sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	21:23 59sec Mon 27 Aug 2007
---vdW_par_bss---
started	21:37 41sec Mon 27 Aug 2007
commencing parameterisation at 21:49 45sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	21:49 50sec Mon 27 Aug 2007
---vdW_par_bss---
started	22:25 21sec Mon 27 Aug 2007
commencing parameterisation at 22:37 26sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	22:37 31sec Mon 27 Aug 2007
---bss3-21G---
started	22:56 40sec Mon 27 Aug 2007
finished	23:05 33sec Mon 27 Aug 2007
---vdW_par_bss---
started	23:23 45sec Mon 27 Aug 2007
commencing parameterisation at 23:35 40sec Mon 27 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:35 44sec Mon 27 Aug 2007
---vdW_par_bss---
started	00:13 44sec Tue 28 Aug 2007
commencing parameterisation at 00:25 52sec Tue 28 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	00:25 57sec Tue 28 Aug 2007
---vdW_par_bss---
started	01:11 48sec Tue 28 Aug 2007
---vdW_par_bss---
started	01:18 20sec Tue 28 Aug 2007
commencing parameterisation at 01:30 08sec Tue 28 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	01:30 12sec Tue 28 Aug 2007
---vdW_par_bss---
started	02:03 18sec Tue 28 Aug 2007
commencing parameterisation at 02:15 30sec Tue 28 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	02:15 35sec Tue 28 Aug 2007
---bss3-21G---
started	03:14 18sec Tue 28 Aug 2007
finished	03:23 18sec Tue 28 Aug 2007
---vdW_par_bss---
started	11:38 14sec Tue 28 Aug 2007
aborted	11:52 15sec Tue 28 Aug 2007
---vdW_par_bss---
started	11:58 51sec Tue 28 Aug 2007
aborted	12:12 38sec Tue 28 Aug 2007
---vdW_par_bss---
started	12:16 57sec Tue 28 Aug 2007
commencing parameterisation at 12:29 56sec Tue 28 Aug 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	12:30 02sec Tue 28 Aug 2007
---par_bss---
started	12:38 21sec Wed 29 Aug 2007
finished	12:48 37sec Wed 29 Aug 2007
---vdW_par_bss---
started	14:10 13sec Sun 2 Sep 2007
commencing parameterisation at 14:11 02sec Sun 2 Sep 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	14:11 02sec Sun 2 Sep 2007
---vdW_par_bss---
started	14:11 12sec Sun 2 Sep 2007
commencing parameterisation at 14:11 59sec Sun 2 Sep 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	14:11 59sec Sun 2 Sep 2007
---vdW_par_bss---
started	14:15 40sec Sun 2 Sep 2007
commencing parameterisation at 14:16 31sec Sun 2 Sep 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	14:16 31sec Sun 2 Sep 2007
---vdW_par_bss---
started	14:17 25sec Sun 2 Sep 2007
commencing parameterisation at 14:18 11sec Sun 2 Sep 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	14:18 11sec Sun 2 Sep 2007
---vdW_par_bss---
started	04:16 01sec Mon 3 Sep 2007
---vdW_par_bss---
started	04:16 45sec Mon 3 Sep 2007
---vdW_par_bss---
started	04:17 33sec Mon 3 Sep 2007
commencing parameterisation at 04:18 29sec Mon 3 Sep 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	04:18 29sec Mon 3 Sep 2007
---vdW_par_bss---
started	13:27 17sec Mon 3 Sep 2007
commencing parameterisation at 13:27 59sec Mon 3 Sep 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	13:27 59sec Mon 3 Sep 2007
---vdW_par_bss---
started	22:29 22sec Mon 3 Sep 2007
---vdW_par_bss---
started	22:32 05sec Mon 3 Sep 2007
commencing parameterisation at 22:32 44sec Mon 3 Sep 2007.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HO H6-O6
The following hardness parameters are tested.
6	12
finished	22:32 44sec Mon 3 Sep 2007
---vdW_par_bss---
started	00:10 24sec Tue 4 Sep 2007
---vdW_par_bss---
started	15:53 37sec Tue 4 Sep 2007
---vdW_par_bss---
started	15:54 48sec Tue 4 Sep 2007
---vdW_par_bss---
started	15:55 50sec Tue 4 Sep 2007
---vdW_par_bss---
started	15:57 17sec Tue 4 Sep 2007
commencing parameterisation at 15:57 31sec Tue 4 Sep 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	15:57 31sec Tue 4 Sep 2007
---steric_tot_en---
started	16:53 11sec Tue 4 Sep 2007
---steric_tot_en---
started	16:55 27sec Tue 4 Sep 2007
---steric_tot_en---
started	16:56 12sec Tue 4 Sep 2007
---steric_tot_en---
started	16:56 37sec Tue 4 Sep 2007
commencing parameterisation at 16:56 48sec Tue 4 Sep 2007.
The following steric interactions will be parameterised
HH H6-H6
The following hardness parameters are tested.
6	12
finished	16:56 48sec Tue 4 Sep 2007
---bss3-21G---
started	15:01 42sec Thu 7 Feb 2008
finished	15:13 42sec Thu 7 Feb 2008
---steric_par_bss---
started	15:42 35sec Thu 7 Feb 2008
commencing parameterisation at 15:57 30sec Thu 7 Feb 2008.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
2	3	4	5	6	7	8	9	10	11	12
---steric_par_bss---
started	16:19 54sec Thu 7 Feb 2008
---steric_par_bss---
started	16:20 33sec Thu 7 Feb 2008
commencing parameterisation at 16:32 48sec Thu 7 Feb 2008.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	16:40 53sec Thu 7 Feb 2008
---steric_par_bss---
started	17:31 15sec Thu 7 Feb 2008
commencing parameterisation at 17:45 14sec Thu 7 Feb 2008.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	17:53 22sec Thu 7 Feb 2008
---par_bss---
started	18:06 47sec Thu 7 Feb 2008
finished	18:19 18sec Thu 7 Feb 2008
---par_bss---
started	19:40 59sec Thu 7 Feb 2008
finished	19:52 25sec Thu 7 Feb 2008
---steric_par_bss---
started	19:56 24sec Thu 7 Feb 2008
commencing parameterisation at 20:06 55sec Thu 7 Feb 2008.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	20:29 29sec Thu 7 Feb 2008
---steric_par_bss---
started	21:46 55sec Thu 7 Feb 2008
commencing parameterisation at 21:58 24sec Thu 7 Feb 2008.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
---steric_par_bss---
started	22:12 16sec Thu 7 Feb 2008
commencing parameterisation at 22:25 30sec Thu 7 Feb 2008.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:01 46sec Thu 7 Feb 2008
---vdW_par_bss---
started	23:07 39sec Thu 7 Feb 2008
commencing parameterisation at 23:25 55sec Thu 7 Feb 2008.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	23:26 00sec Thu 7 Feb 2008
---vdW_par_bss---
started	01:02 46sec Fri 8 Feb 2008
---vdW_par_bss---
started	01:50 26sec Fri 8 Feb 2008
commencing parameterisation at 02:06 08sec Fri 8 Feb 2008.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	02:06 14sec Fri 8 Feb 2008
---vdW_par_bss---
started	02:10 09sec Fri 8 Feb 2008
commencing parameterisation at 02:26 11sec Fri 8 Feb 2008.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	02:26 17sec Fri 8 Feb 2008
---vdW_par_bss---
started	02:43 35sec Fri 8 Feb 2008
commencing parameterisation at 02:58 28sec Fri 8 Feb 2008.
The following steric interactions will be parameterised
HH H21-H6	HH H6-H6	HN H6-N61	HN H6-N8	HN H6-N9	HO H21-O7	HO H6-O6	HO H6-O7	NN N61-N61	NO N8-O7	OO O7-O7
The following hardness parameters are tested.
6	12
finished	02:58 33sec Fri 8 Feb 2008
---par_bss---
started	14:27 11sec Fri 8 Feb 2008
finished	14:28 02sec Fri 8 Feb 2008
---par_bss---
started	14:29 54sec Fri 8 Feb 2008
---par_bss---
started	14:30 36sec Fri 8 Feb 2008
finished	14:31 28sec Fri 8 Feb 2008
---par_bss---
started	14:40 20sec Fri 8 Feb 2008
finished	14:41 12sec Fri 8 Feb 2008
---par_bss---
started	14:53 52sec Fri 8 Feb 2008
finished	14:54 42sec Fri 8 Feb 2008
---par_bss---
started	15:09 45sec Fri 8 Feb 2008
finished	15:10 36sec Fri 8 Feb 2008
---par_bss---
started	15:16 28sec Fri 8 Feb 2008
---par_bss---
started	15:16 54sec Fri 8 Feb 2008
finished	15:17 52sec Fri 8 Feb 2008
---par_bss---
started	10:39 37sec Mon 18 Feb 2008
aborted	10:40 26sec Mon 18 Feb 2008
---par_bss---
started	11:01 46sec Mon 18 Feb 2008
finished	11:02 33sec Mon 18 Feb 2008
---par_bss---
started	11:04 30sec Mon 18 Feb 2008
finished	11:05 19sec Mon 18 Feb 2008