ATOM 37
1 C1y C 25.8201 -15.4584
2 N1y N 24.4780 -15.4584
3 C1x C 24.0635 -16.7348
4 C1x C 25.1491 -17.5236
5 C1x C 26.2350 -16.7348
6 C5a C 26.9824 -14.7874
7 N1b N 28.1446 -15.4584
8 C1c C 29.3068 -14.7874
9 C1b C 30.4690 -15.4584
10 O5a O 26.9824 -13.4455
11 C6a C 29.3068 -13.4455
12 O6a O 30.4710 -12.7733
13 O6a O 28.1465 -12.7756
14 C8y C 31.6338 -14.7859
15 C8x C 32.7979 -15.4581
16 C8x C 33.9602 -14.7871
17 C8x C 33.9602 -13.4451
18 C8x C 32.7960 -12.7729
19 C8x C 31.6338 -13.4440
20 C5a C 23.3159 -14.7874
21 C1c C 22.1537 -15.4584
22 N1b N 20.9916 -14.7874
23 C5a C 19.8293 -15.4584
24 C1c C 18.6671 -14.7874
25 N1a N 17.5050 -15.4584
26 O5a O 23.3159 -13.4455
27 C1b C 22.1537 -18.8578
28 C8y C 23.3195 -19.5308
29 C8x C 23.4600 -20.8678
30 N5x N 24.7749 -21.1474
31 C8x C 25.4472 -19.9832
32 N4x N 24.5476 -18.9841
33 O5a O 19.8293 -16.8039
34 C1c C 18.6671 -12.7654
35 C1b C 19.8309 -12.0934
36 C1a C 17.5058 -12.0949
37 C1a C 19.8309 -10.7517
BOND 39
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 1 6 1 #Down
7 6 7 1
8 7 8 1
9 8 9 1
10 6 10 2
11 8 11 1 #Down
12 11 12 1
13 11 13 2
14 9 14 1
15 14 15 2
16 15 16 1
17 16 17 2
18 17 18 1
19 18 19 2
20 14 19 1
21 2 20 1
22 20 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 24 25 1 #Up
27 20 26 2
28 21 27 1 #Down
29 27 28 1
30 28 29 2
31 29 30 1
32 30 31 2
33 31 32 1
34 28 32 1
35 23 33 2
36 24 34 1
37 34 35 1
38 34 36 1 #Up
39 35 37 1
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