ATOM 22
1 C1a C 16.4502 -15.3304
2 C1b C 17.6626 -14.6304
3 C1b C 18.8751 -15.3304
4 C1b C 20.0875 -14.6304
5 O7a O 21.3000 -15.3304
6 C7a C 22.5125 -14.6304
7 C1b C 23.7249 -15.3304
8 C1b C 24.9374 -14.6304
9 C7a C 26.4299 -15.3304
10 O7a O 27.6423 -14.6304
11 C1b C 28.8548 -15.3304
12 C1b C 30.0673 -14.6304
13 C1b C 31.2797 -15.3304
14 C1a C 32.4922 -14.6304
15 O6a O 22.5125 -13.2306
16 O6a O 26.4894 -16.7297
17 C1b C 23.7249 -15.3304
18 C1b C 24.9374 -14.6304
19 C1b C 23.7249 -15.3304
20 C1b C 24.9374 -14.6304
21 C1b C 23.7249 -15.3304
22 C1b C 24.9374 -14.6304
BOND 21
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 9 10 1
7 10 11 1
8 11 12 1
9 12 13 1
10 13 14 1
11 6 15 2
12 9 16 2
13 6 7 1
14 7 8 1
15 8 17 1
16 17 18 1
17 18 19 1
18 19 20 1
19 20 21 1
20 21 22 1
21 22 9 1
BRACKET 1 23.3800 -16.1700 23.3800 -14.3500
1 25.0600 -14.3500 25.0600 -16.1700
1 4
ORIGINAL 1 7 8
REPEAT 1 17 18 19 20 21 22
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