ATOM 35
1 S2x S 26.8035 -16.2989
2 C2y C 26.8035 -17.6544
3 C2y C 27.9816 -18.3322
4 S2x S 29.1527 -17.6544
5 C1x C 29.1527 -16.2989
6 C1x C 27.9816 -15.6141
7 C1y C 28.0252 -20.7538
8 C2y C 26.8579 -21.4317
9 C2y C 26.8598 -22.7872
10 N1x N 28.0350 -23.4670
11 C2y C 29.2083 -22.7841
12 C2y C 29.2066 -21.4286
13 C7a C 30.3720 -20.7463
14 C1a C 30.3775 -23.4603
15 C1a C 25.6924 -23.4664
16 C7a C 25.6891 -20.7550
17 O7a O 31.5430 -21.4193
18 O6a O 30.3668 -19.3978
19 C1a C 25.6461 -18.3405
20 O7a O 24.5216 -21.4339
21 O6a O 25.6880 -19.4066
22 C1b C 32.7523 -20.7180
23 C8y C 33.9641 -21.4146
24 C8x C 33.9641 -22.8077
25 C8x C 35.1759 -23.5042
26 N5x N 36.3852 -22.8029
27 C8x C 36.3825 -21.4051
28 C8x C 35.1705 -20.7085
29 C1b C 23.3089 -20.7387
30 C8y C 22.1005 -21.4413
31 C8x C 20.8939 -20.7416
32 C8x C 19.6855 -21.4442
33 N5x N 19.6899 -22.8421
34 C8x C 20.9026 -23.5373
35 C8x C 22.1110 -22.8346
BOND 38
1 8 9 2
2 9 10 1
3 10 11 1
4 11 12 2
5 12 7 1
6 4 5 1
7 12 13 1
8 5 6 1
9 11 14 1
10 17 22 1
11 6 1 1
12 22 23 1
13 9 15 1
14 8 16 1
15 3 7 1
16 13 17 1
17 2 19 1
18 23 24 1
19 24 25 2
20 25 26 1
21 26 27 2
22 27 28 1
23 28 23 2
24 13 18 2
25 20 29 1
26 16 20 1
27 29 30 1
28 1 2 1
29 16 21 2
30 2 3 2
31 3 4 1
32 7 8 1
33 30 31 2
34 31 32 1
35 32 33 2
36 33 34 1
37 34 35 2
38 35 30 1
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