ATOM 43
1 C8y C 19.5713 -17.8294
2 C2b C 18.3279 -18.3718
3 N4x N 19.6657 -16.4740
4 C8y C 20.9035 -18.3421
5 C2y C 17.0483 -17.8610
6 C8y C 20.9860 -16.1591
7 C8y C 21.7126 -17.3069
8 C2y C 15.8414 -18.4666
9 N2x N 16.8337 -16.5103
10 C2b C 21.4737 -14.9391
11 N2x N 16.7392 -13.5826
12 C2y C 14.8708 -17.5615
13 C2y C 15.5018 -16.2899
14 C2y C 20.9743 -13.7204
15 C2y C 16.9119 -12.2321
16 C2y C 15.3887 -13.8207
17 C2b C 14.9607 -15.0886
18 C2y C 21.5867 -12.4886
19 N2x N 19.6296 -13.5115
20 C2y C 15.6802 -11.6559
21 C2y C 14.7473 -12.6309
22 C2y C 20.6174 -11.5487
23 C2x C 19.4102 -12.1797
24 C2b C 15.6686 -10.2820
25 C1a C 13.3791 -12.6309
26 C1a C 20.6058 -10.1746
27 C2a C 16.8531 -9.5814
28 C2b C 22.9432 -12.2630
29 C2a C 23.8580 -13.3741
30 C1b C 20.8664 -19.7864
31 C1b C 22.1081 -20.5369
32 C6a C 22.0716 -21.9800
33 O6a O 23.3131 -22.7306
34 O6a O 20.8076 -22.6796
35 C1b C 15.7863 -19.8114
36 C1b C 14.5886 -20.4432
37 C6a C 14.5336 -21.7879
38 O6a O 13.3360 -22.4126
39 O6a O 15.6694 -22.5148
40 C1a C 13.4286 -17.6278
41 C1a C 23.0214 -17.3701
42 C2b C 18.1520 -11.5493
43 C2a C 18.1520 -10.1493
BOND 46
1 11 16 1
2 13 17 1
3 14 18 1
4 14 19 1
5 15 20 1
6 16 21 1
7 18 22 2
8 19 23 2
9 20 24 1
10 21 25 1
11 22 26 1
12 6 7 2
13 12 13 1
14 16 17 2
15 20 21 2
16 22 23 1
17 24 27 2
18 18 28 1
19 28 29 2
20 1 2 1
21 4 30 1
22 1 3 1
23 30 31 1
24 1 4 2
25 31 32 1
26 2 5 2
27 32 33 2
28 3 6 1
29 32 34 1
30 4 7 1
31 8 35 1
32 5 8 1
33 35 36 1
34 5 9 1
35 36 37 1
36 6 10 1
37 37 38 1
38 8 12 2
39 37 39 2
40 9 13 2
41 12 40 1
42 10 14 2
43 7 41 1
44 11 15 2
45 15 42 1
46 42 43 2
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