ATOM 31
1 C8y C 14.2085 -15.9154
2 N4y N 15.3978 -15.3254
3 C8y C 16.7222 -15.9364
4 C1y C 17.0227 -17.2884
5 C8y C 13.8898 -17.2824
6 N1x N 16.1530 -18.3819
7 C5x C 14.7569 -18.3753
8 C8x C 13.1904 -14.9621
9 C8x C 11.8558 -15.3670
10 C8x C 11.5372 -16.7341
11 C8x C 12.5552 -17.6874
12 N5x N 17.8781 -15.1559
13 C8y C 17.8501 -13.7646
14 C8y C 16.5256 -13.1536
15 C8y C 15.3698 -13.9341
16 C8x C 19.0059 -13.1940
17 C8x C 19.0479 -11.5928
18 C8x C 17.7935 -10.9118
19 C8x C 16.4977 -11.7624
20 O5x O 14.1132 -13.3222
21 O5x O 14.1474 -19.6291
22 C1b C 18.2601 -17.9533
23 C8y C 19.4681 -17.2560
24 C8x C 20.6945 -17.9643
25 N4x N 21.7473 -17.0168
26 C8y C 21.1713 -15.7228
27 C8y C 19.7628 -15.8706
28 C8x C 21.7388 -14.4487
29 C8x C 20.9192 -13.3203
30 C8x C 19.5105 -13.4681
31 C8x C 18.9431 -14.7422
BOND 36
1 3 4 1
2 1 5 2
3 4 6 1
4 2 3 1
5 5 7 1
6 1 2 1
7 6 7 1
8 1 8 1
9 8 9 2
10 9 10 1
11 10 11 2
12 5 11 1
13 3 12 2
14 12 13 1
15 13 14 2
16 14 15 1
17 2 15 1
18 13 16 1
19 16 17 2
20 17 18 1
21 18 19 2
22 14 19 1
23 15 20 2
24 7 21 2
25 4 22 1 #Down
26 22 23 1
27 23 24 2
28 24 25 1
29 25 26 1
30 26 27 2
31 23 27 1
32 26 28 1
33 28 29 2
34 29 30 1
35 30 31 2
36 27 31 1
| 
