ATOM 25
1 C8y C 22.3632 -20.4218
2 C8y C 23.5034 -19.7260
3 C1c C 20.9661 -19.9775
4 C8y C 22.3574 -21.8252
5 C8y C 24.7080 -20.4276
6 O7x O 23.5095 -18.3287
7 C4a C 20.1358 -21.1176
8 C1c C 20.1415 -18.8316
9 C8x C 23.5034 -22.5209
10 C8y C 25.9241 -19.7377
11 C8y C 24.7080 -21.8252
12 C8y C 24.7255 -17.6388
13 O4a O 18.7968 -20.6733
14 C4a C 18.8027 -19.2642
15 C8y C 25.9298 -18.3404
16 C1x C 27.2455 -20.1763
17 O2a O 25.9241 -22.5209
18 O6a O 24.7138 -16.2355
19 C5x C 27.2572 -17.9194
20 C1x C 28.0699 -19.0479
21 C1a C 27.1286 -21.8075
22 O5x O 27.6957 -16.5863
23 O4a O 17.6916 -18.4524
24 O1a O 20.5848 -17.4822
25 O1a O 21.1087 -22.5245
BOND 27
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 6 12 1
12 7 13 2
13 8 14 1
14 10 15 2
15 10 16 1
16 11 17 1
17 12 18 2
18 15 19 1
19 16 20 1
20 17 21 1
21 19 22 2
22 9 11 2
23 12 15 1
24 19 20 1
25 14 23 2
26 8 24 1 #Down
27 4 25 1
|