ATOM 35
1 C8x C 11.8300 -24.2200
2 C8x C 11.8300 -25.6200
3 C8x C 13.0424 -26.3200
4 C8y C 14.2549 -25.6200
5 C8y C 14.2549 -24.2200
6 C8x C 13.0424 -23.5200
7 O2x O 15.5864 -26.0526
8 C8y C 16.4093 -24.9200
9 C8y C 15.5864 -23.7874
10 C1b C 17.7800 -24.9200
11 C5a C 15.5864 -22.3874
12 C8y C 16.8108 -21.6802
13 O5a O 14.3971 -21.7008
14 C8x C 18.0237 -22.3802
15 C8y C 19.2360 -21.6800
16 C8y C 19.2357 -20.2800
17 C8y C 18.0229 -19.5800
18 C8x C 16.8105 -20.2802
19 O2a O 20.4499 -19.5787
20 X I 20.4678 -22.3907
21 X I 18.0222 -18.2004
22 C1b C 21.6641 -20.2794
23 C1b C 22.8419 -19.5991
24 N1c N 24.0383 -20.2897
25 C1b C 25.2249 -19.6043
26 C1b C 24.0387 -21.6997
27 C1a C 26.4168 -20.2924
28 C1a C 25.2297 -22.3872
29 C7a C 18.4800 -26.1324
30 O7a O 19.8798 -26.1324
31 O6a O 17.7896 -27.3279
32 C1c C 20.5703 -27.3280
33 C1b C 21.9797 -27.3280
34 C1a C 22.6921 -26.0946
35 C1a C 19.8848 -28.5152
BOND 37
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 2
10 5 9 1
11 8 10 1
12 9 11 1
13 11 12 1
14 11 13 2
15 12 14 2
16 14 15 1
17 15 16 2
18 16 17 1
19 17 18 2
20 12 18 1
21 16 19 1
22 15 20 1
23 17 21 1
24 19 22 1
25 22 23 1
26 23 24 1
27 24 25 1
28 24 26 1
29 25 27 1
30 26 28 1
31 10 29 1
32 29 30 1
33 29 31 2
34 30 32 1
35 32 33 1
36 33 34 1
37 32 35 1 #Down
|