ATOM 37
1 C1z C 35.2825 -19.0522
2 C5a C 36.5070 -18.3532
3 N1a N 37.7244 -19.0522
4 O5a O 36.5070 -16.9415
5 N1y N 27.9192 -20.4167
6 C1y C 27.9250 -19.0052
7 C2y C 29.1380 -21.1318
8 C5x C 26.5077 -20.4225
9 C1y C 26.5077 -19.0052
10 S2x S 29.1554 -18.3016
11 C2y C 30.3615 -20.4284
12 C6a C 29.1321 -22.5491
13 O5x O 25.5064 -21.4296
14 N1b N 25.5088 -17.9974
15 C1x C 30.3673 -19.0168
16 C1b C 31.5860 -21.1493
17 O6a O 30.3556 -23.2632
18 O6a O 27.6407 -23.5480 #-
19 C5a C 24.2541 -18.6615
20 C2c C 23.0470 -17.8959
21 O5a O 24.1980 -20.0800
22 C8y C 21.7793 -18.5576
23 N2b N 23.0232 -16.4871
24 N5x N 20.6270 -17.7340
25 N5x N 21.3516 -19.9175
26 O2a O 24.2709 -15.8245
27 C8y C 19.4798 -18.5849
28 S2x S 19.9274 -19.9223
29 C1a C 25.6278 -16.2421
30 N2y N 32.8228 -20.4455 #+
31 C1x C 34.0322 -21.1716
32 C1x C 35.2761 -20.4677
33 C1x C 34.0532 -18.3339
34 C1x C 32.8304 -19.0309
35 C1x C 34.1228 -20.1924
36 C1x C 34.4110 -19.4006
37 N1a N 18.1542 -18.1621
BOND 41
1 1 2 1
2 2 4 2
3 2 3 1
4 10 15 1
5 11 16 1
6 12 17 2
7 12 18 1
8 14 19 1
9 19 20 1
10 19 21 2
11 20 22 1
12 20 23 2
13 22 24 1
14 22 25 2
15 23 26 1
16 24 27 2
17 25 28 1
18 26 29 1
19 8 9 1
20 11 15 1
21 27 28 1
22 16 30 1
23 5 6 1
24 5 7 1
25 5 8 1
26 6 9 1
27 30 31 1
28 31 32 1
29 32 1 1
30 1 33 1
31 33 34 1
32 34 30 1
33 6 10 1
34 7 11 2
35 30 35 1
36 7 12 1
37 35 36 1
38 8 13 2
39 36 1 1
40 9 14 1 #Up
41 27 37 1
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