ATOM 35
1 C1y C 30.6857 -17.5191
2 C5x C 30.6871 -18.9142
3 N1y N 32.0079 -18.9054
4 C1x C 32.0693 -17.5142
5 O5x O 29.7055 -19.9084
6 N1b N 29.9833 -16.3027
7 C5a C 28.7769 -17.0144
8 C1c C 27.5598 -16.3118
9 C8y C 26.3427 -17.0144
10 O5a O 28.7836 -18.4198
11 N1a N 27.5598 -14.9068
12 C1c C 33.2409 -19.6189
13 C8y C 34.4546 -18.9182
14 C8x C 35.6682 -19.6189
15 C6a C 33.2403 -21.0199
16 O6a O 32.0101 -21.7297
17 O6a O 34.4373 -21.7120
18 C8x C 36.8817 -18.9182
19 C8y C 36.8817 -17.5169
20 C8x C 35.6682 -16.8161
21 C8x C 34.4546 -17.5169
22 O1a O 38.0804 -16.8246
23 C8x C 25.1291 -16.3138
24 C8x C 23.9155 -17.0144
25 C8y C 23.9155 -18.4157
26 C8x C 25.1291 -19.1166
27 C8x C 26.3427 -18.4157
28 O2a O 22.6862 -19.1285
29 C1b C 21.4727 -18.4278
30 C1b C 20.2590 -19.1285
31 C1c C 19.0456 -18.4278
32 C6a C 17.8319 -19.1285
33 N1a N 19.0456 -17.0264
34 O6a O 16.5976 -18.4154
35 O6a O 17.8318 -20.5294
BOND 37
1 1 2 1
2 2 3 1
3 3 4 1
4 1 4 1
5 2 5 2
6 1 6 1 #Up
7 6 7 1
8 7 8 1
9 8 9 1
10 7 10 2
11 8 11 1 #Up
12 3 12 1
13 12 13 1
14 13 14 1
15 12 15 1 #Down
16 15 16 2
17 15 17 1
18 14 18 2
19 18 19 1
20 19 20 2
21 20 21 1
22 13 21 2
23 19 22 1
24 9 23 2
25 23 24 1
26 24 25 2
27 25 26 1
28 26 27 2
29 9 27 1
30 25 28 1
31 28 29 1
32 29 30 1
33 30 31 1
34 31 32 1
35 31 33 1 #Up
36 32 34 1
37 32 35 2
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