ATOM 26
1 N1b N 35.9298 -18.7037
2 C8x C 27.4551 -16.6129
3 C8y C 27.4531 -18.0166
4 C8x C 28.6667 -18.7207
5 C8y C 29.8763 -18.0157
6 C8x C 29.8714 -16.6068
7 C8x C 28.6637 -15.9162
8 O2a O 31.0903 -18.7178
9 C1b C 32.3003 -18.0144
10 C1b C 33.5100 -18.7108
11 C1b C 34.7199 -18.0073
12 C1b C 26.2393 -18.7190
13 N1y N 25.0267 -18.0147
14 C1x C 25.0385 -16.6137
15 C1x C 23.8330 -15.9167
16 C1x C 22.6150 -16.6061
17 C1x C 22.6106 -18.0075
18 C1x C 23.8241 -18.7194
19 C8y C 37.1408 -17.9963
20 N4y N 37.1408 -16.5963
21 C1a C 35.9477 -15.9073
22 N5x N 38.4723 -18.4290
23 C8y C 39.2952 -17.2963
24 N5x N 38.4723 -16.1637
25 C1b C 40.6700 -17.2962
26 O1a O 41.3726 -16.0791
BOND 28
1 3 12 1
2 4 5 2
3 12 13 1
4 13 14 1
5 5 6 1
6 6 7 2
7 7 2 1
8 13 18 1
9 14 15 1
10 15 16 1
11 16 17 1
12 17 18 1
13 1 19 1
14 8 9 1
15 9 10 1
16 2 3 2
17 10 11 1
18 11 1 1
19 8 5 1
20 3 4 1
21 19 20 1
22 20 21 1
23 19 22 2
24 22 23 1
25 23 24 2
26 20 24 1
27 23 25 1
28 25 26 1
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