ATOM 35
1 C1y C 25.8855 -14.8910
2 N1y N 25.8855 -16.2900
3 C2y C 27.0971 -16.9894
4 C2y C 28.3088 -16.2900
5 C1x C 28.3088 -14.8910
6 S2x S 27.0971 -14.1915
7 C1y C 24.4864 -14.8910
8 C5x C 24.4864 -16.2900
9 N1b N 23.2750 -14.1915
10 C5a C 22.0632 -14.8910
11 O5a O 22.0632 -16.2900
12 O5x O 23.2750 -16.9894
13 C1c C 20.8516 -14.1915
14 C1b C 29.5390 -17.0005
15 C6a C 27.0971 -18.3882
16 O6a O 25.8687 -19.0977
17 O6a O 28.2918 -19.0782
18 C8y C 19.6205 -14.9026
19 C8x C 18.4103 -14.2039
20 C8x C 17.2002 -14.9026
21 C8x C 17.2002 -16.2998
22 C8x C 18.4103 -16.9986
23 C8x C 19.6205 -16.2998
24 O1a O 20.8516 -12.7878
25 S2a S 30.7555 -16.2984
26 C8y C 31.9669 -16.9981
27 N5x N 32.3908 -18.2438
28 N5x N 33.7904 -18.2742
29 N5x N 34.2520 -16.9525
30 N4y N 33.1375 -16.1052
31 C1b C 33.1362 -14.6947
32 S4a S 34.3331 -14.0023
33 O1d O 35.5460 -13.3021
34 O1d O 33.6283 -12.7824
35 O1d O 35.0294 -15.2074
BOND 38
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 3 15 1
17 15 16 2
18 15 17 1
19 13 18 1
20 18 19 2
21 19 20 1
22 20 21 2
23 21 22 1
24 22 23 2
25 18 23 1
26 13 24 1 #Up
27 14 25 1
28 25 26 1
29 26 27 2
30 27 28 1
31 28 29 2
32 29 30 1
33 26 30 1
34 30 31 1
35 31 32 1
36 32 33 1
37 32 34 2
38 32 35 2
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