ATOM 35
1 C1y C 30.8619 -17.0109
2 C1y C 30.2619 -18.2377
3 C1y C 32.2283 -16.9119
4 C1x C 30.2735 -15.7725
5 C1x C 28.9244 -18.5523
6 C1x C 31.0297 -19.3652
7 C1x C 32.9962 -18.0396
8 C1y C 28.9361 -15.4637
9 C2y C 27.8608 -17.6853
10 C1y C 32.3903 -19.2792
11 C1x C 29.9767 -14.5524
12 C1z C 27.8667 -16.3247
13 N2x N 26.6808 -18.3658
14 C1a C 33.0648 -20.4477
15 C1x C 26.6867 -15.6385
16 C1y C 25.4994 -17.6796
17 C1x C 25.4994 -16.3190
18 C1b C 24.3252 -18.3658
19 C1y C 24.3311 -19.7264
20 C1y C 25.5052 -20.4068
21 C1x C 23.1393 -20.4068
22 C1y C 25.4994 -21.7734
23 C1x C 26.6925 -19.7264
24 C1y C 23.1393 -21.7734
25 N1y N 26.6808 -22.4596
26 C1x C 24.3311 -22.4538
27 C1x C 27.8667 -20.4185
28 C1a C 21.9522 -22.4479
29 C1x C 27.8725 -21.7850
30 C5a C 26.6751 -23.8142
31 C1a C 27.8551 -24.4890
32 O5a O 25.4935 -24.4947
33 O1a O 27.8551 -14.9523
34 N1y N 32.8293 -15.6720
35 C1a C 34.1129 -15.1636
BOND 40
1 1 3 1
2 1 4 1
3 2 5 1
4 2 6 1
5 3 7 1
6 4 8 1
7 5 9 1
8 6 10 1
9 8 12 1
10 9 13 2
11 10 14 1 #Down
12 12 15 1
13 13 16 1
14 15 17 1
15 16 18 1
16 18 19 1
17 19 20 1
18 19 21 1
19 20 22 1
20 20 23 1
21 21 24 1
22 22 25 1
23 22 26 1
24 23 27 1
25 24 28 1 #Up
26 25 29 1
27 25 30 1
28 30 31 1
29 30 32 2
30 7 10 1
31 8 11 1 #Up
32 9 12 1
33 16 17 1
34 24 26 1
35 27 29 1
36 12 33 1 #Up
37 3 34 1 #Up
38 34 11 1
39 1 2 1
40 34 35 1
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