ATOM 28
1 C1b C 18.9700 -17.2900
2 C7a C 20.1824 -16.5900
3 O7a O 21.3949 -17.2900
4 O7a O 22.6073 -16.5900
5 C7a C 23.8197 -17.2900
6 C1b C 25.0322 -16.5900
7 O6a O 20.1824 -15.1900
8 O6a O 23.8197 -18.6900
9 C1b C 26.2724 -17.2900
10 C1b C 27.4849 -16.5900
11 C1b C 28.6973 -17.2900
12 C1b C 29.9097 -16.5900
13 C1b C 31.1222 -17.2900
14 C1b C 32.3346 -16.5900
15 C1b C 33.5470 -17.2900
16 C1b C 17.7576 -16.5900
17 C1b C 16.5451 -17.2900
18 C1b C 15.3327 -16.5900
19 C1b C 14.1203 -17.2900
20 C1b C 12.9078 -16.5900
21 C1b C 11.6954 -17.2900
22 C1b C 34.7466 -16.5973
23 C1b C 35.9359 -17.2840
24 C1a C 37.1262 -16.5966
25 C1b C 10.4789 -16.5877
26 C1b C 9.2814 -17.2792
27 C1b C 8.0951 -16.5943
28 C1a C 6.9033 -17.2826
BOND 27
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 2 7 2
7 5 8 2
8 6 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 1 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 20 21 1
21 15 22 1
22 22 23 1
23 23 24 1
24 21 25 1
25 25 26 1
26 26 27 1
27 27 28 1
|