ATOM 36
1 N1x N 30.1996 -16.8596
2 C1y C 26.5674 -21.7251
3 C5x C 28.9547 -17.5341
4 C5x C 27.7740 -20.9081
5 C1c C 26.5674 -23.0742
6 C1y C 28.9489 -18.8774
7 N1x N 27.7740 -19.5518
8 O5x O 28.9489 -21.5827
9 C1b C 25.3924 -23.7429
10 C1a C 27.7364 -23.7546
11 C1b C 30.1179 -19.5577
12 C1a C 25.3924 -25.1048
13 C8y C 31.2928 -18.8774
14 C8x C 32.4676 -19.5518
15 C8x C 31.2928 -17.5224
16 C8x C 33.6366 -18.8774
17 C8x C 32.4617 -16.8479
18 C8x C 33.6366 -17.5224
19 C8y C 26.1150 -16.6524
20 C8y C 24.9343 -15.9721
21 C8x C 27.2781 -15.9721
22 C1x C 26.0976 -18.0073
23 C8x C 24.9343 -14.6172
24 O2a O 23.7594 -16.6275
25 C8y C 27.2840 -14.6172
26 C1y C 24.7836 -18.3626
27 C8x C 26.1150 -13.9355
28 C1a C 22.5904 -15.9721
29 C2x C 28.4647 -13.9355
30 C5x C 24.4221 -19.6708
31 N1b N 23.6027 -17.6751
32 C2x C 30.1425 -14.9185
33 N1x N 24.9627 -20.9671
34 O5x O 23.1082 -19.6633
35 C1a C 22.4278 -18.3569
36 O5x O 27.7808 -16.8523
BOND 38
1 17 18 1
2 1 3 1
3 2 4 1
4 2 5 1
5 3 6 1
6 4 7 1
7 4 8 2
8 5 9 1
9 5 10 1 #Up
10 6 11 1 #Down
11 9 12 1
12 11 13 1
13 13 14 2
14 13 15 1
15 14 16 1
16 15 17 2
17 16 18 2
18 19 20 2
19 19 21 1
20 19 22 1
21 20 23 1
22 20 24 1
23 21 25 2
24 22 26 1
25 23 27 2
26 24 28 1
27 25 29 1
28 26 30 1
29 26 31 1 #Up
30 29 32 2
31 30 33 1
32 30 34 2
33 31 35 1
34 25 27 1
35 32 1 1
36 6 7 1
37 3 36 2
38 2 33 1
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