ATOM 35
1 C1y C 25.4475 -19.5006
2 N1y N 25.4475 -20.8930
3 C2y C 26.6309 -21.5892
4 C2y C 27.8145 -20.8930
5 C1x C 27.8145 -19.5006
6 S2x S 26.6309 -18.8044
7 C1y C 24.0550 -19.5006
8 C5x C 24.0550 -20.8930
9 N1b N 22.8019 -18.8044
10 C5a C 21.6185 -19.5006
11 O5a O 21.6185 -20.8930
12 O5x O 22.8019 -21.5892
13 C2c C 20.4349 -18.8044
14 C1b C 29.0676 -21.5892
15 C8y C 19.1818 -19.5006
16 N5y N 30.2512 -20.8930 #+
17 N5x N 18.1375 -18.6651
18 S2x S 16.9540 -19.4310
19 C8y C 17.3717 -20.8233
20 N5x N 18.7639 -20.8233
21 N2b N 20.4349 -17.4119
22 C6a C 26.6309 -22.9815
23 O6a O 27.8145 -23.6778 #-
24 O6a O 25.3778 -23.6778
25 N1a N 16.5363 -21.9372
26 C8y C 31.3948 -21.6916
27 N4y N 32.5089 -20.8534
28 C8x C 32.0560 -19.5349
29 C8x C 30.6621 -19.5582
30 C8x C 31.3948 -23.0836
31 C8x C 32.5886 -23.7737
32 C8x C 33.8255 -23.0606
33 N5x N 33.8255 -21.6685
34 O2a O 21.6791 -16.7003
35 C1a C 21.6791 -15.3033
BOND 39
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 1
7 1 7 1
8 7 8 1
9 2 8 1
10 7 9 1 #Up
11 9 10 1
12 10 11 2
13 8 12 2
14 10 13 1
15 4 14 1
16 13 15 1
17 14 16 1
18 15 17 2
19 17 18 1
20 18 19 1
21 19 20 2
22 15 20 1
23 13 21 2
24 3 22 1
25 22 23 1
26 22 24 2
27 19 25 1
28 16 26 2
29 26 27 1
30 27 28 1
31 28 29 2
32 16 29 1
33 26 30 1
34 30 31 2
35 31 32 1
36 32 33 2
37 33 27 1
38 21 34 1
39 34 35 1
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