ATOM 25
1 C8y C 26.7135 -18.8565
2 C8y C 26.7135 -17.4567
3 C8y C 27.9287 -16.7568
4 C8y C 27.9287 -19.5564
5 C8y C 29.1368 -18.8565
6 C8y C 29.1310 -17.4533
7 S2x S 30.4638 -17.0140
8 C8y C 31.2930 -18.1459
9 N5x N 30.4731 -19.2846
10 N1b N 32.6929 -18.1402
11 C1a C 33.3878 -16.9249
12 C1a C 27.9304 -15.3570
13 O2a O 25.5015 -16.7563
14 C1a C 25.5015 -19.5571
15 C1b C 27.9304 -20.9563
16 C8y C 29.1436 -21.6547
17 C8x C 29.1397 -23.0486
18 N5x N 30.3528 -23.7469
19 C8x C 31.5642 -23.0455
20 C8x C 31.5625 -21.6457
21 C8x C 30.3493 -20.9473
22 S4a S 24.0976 -16.7429
23 O1d O 24.0906 -15.3430
24 O1d O 22.6977 -16.7429
25 O1d O 24.0906 -18.1427
BOND 27
1 3 12 1
2 1 2 1
3 2 13 1
4 2 3 2
5 1 14 1
6 3 6 1
7 4 15 1
8 5 4 1
9 15 16 1
10 5 6 2
11 6 7 1
12 7 8 1
13 8 9 2
14 9 5 1
15 16 17 2
16 17 18 1
17 18 19 2
18 19 20 1
19 20 21 2
20 21 16 1
21 4 1 2
22 13 22 1
23 8 10 1
24 22 23 1
25 10 11 1
26 22 24 2
27 22 25 2
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