ATOM 37
1 C8y C 6.5063 -16.1593
2 C8y C 7.8412 -16.4403
3 C8y C 5.8037 -17.3536
4 C8x C 5.8037 -14.8947
5 C1b C 8.8950 -15.5972
6 N4x N 6.6468 -18.4075
7 C8x C 4.3284 -17.3536
8 C8x C 4.3986 -14.8947
9 C1c C 10.1597 -16.2296
10 C8x C 3.6258 -16.1593
11 N1a N 10.1597 -17.7049
12 C7a C 11.3540 -15.5972
13 O7a O 12.5484 -16.2998
14 O6a O 11.3540 -14.1921
15 C8x C 7.8412 -17.8444
16 N4y N 21.4190 -15.4461
17 C8y C 22.3317 -16.1482
18 C1y C 20.0850 -15.8674
19 C8x C 21.7700 -13.9016
20 C8y C 23.5252 -15.1653
21 N5x N 22.4721 -17.5524
22 O2x O 18.9617 -14.8845
23 C1y C 19.6638 -17.0609
24 N5x N 23.1040 -13.9016
25 C8y C 24.8592 -15.7972
26 C8x C 23.8061 -18.1140
27 C1y C 17.8384 -15.7972
28 C1y C 18.2596 -17.0609
29 O1a O 20.3659 -18.1842
30 N5x N 24.9996 -17.2013
31 N1a N 25.9123 -14.8845
32 C1b C 16.5044 -15.3759
33 O1a O 17.8384 -18.2544
34 O2b O 15.4513 -16.2886
35 P1b P 14.0472 -16.2886
36 O1c O 14.0472 -17.6226
37 O1c O 14.0472 -14.8143
BOND 41
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 3 6 1
6 3 7 1
7 4 8 2
8 5 9 1
9 7 10 2
10 9 11 1 #Up
11 9 12 1
12 12 13 1
13 12 14 2
14 8 10 1
15 2 15 2
16 15 6 1
17 16 17 1
18 18 16 1 #Up
19 16 19 1
20 17 20 2
21 17 21 1
22 18 22 1
23 18 23 1
24 19 24 2
25 20 25 1
26 21 26 2
27 22 27 1
28 23 28 1
29 23 29 1 #Down
30 25 30 2
31 25 31 1
32 27 32 1 #Up
33 28 33 1 #Down
34 32 34 1
35 34 35 1
36 35 36 1
37 35 37 2
38 20 24 1
39 26 30 1
40 27 28 1
41 13 35 1
| 
