ATOM 26
1 C8y C 22.1142 -18.5674
2 N1y N 23.3450 -17.8966
3 C8y C 22.0851 -19.9671
4 C8x C 20.9128 -17.8442
5 C8y C 24.5349 -18.6256
6 C1b C 23.3040 -16.4967
7 S2x S 23.2749 -20.6904
8 C8x C 20.8602 -20.6437
9 C8x C 19.6820 -18.5265
10 C8y C 24.4999 -20.0255
11 C8x C 25.7655 -17.9549
12 C1b C 24.5407 -15.8260
13 C8x C 19.6587 -19.9323
14 C8x C 25.6897 -20.7488
15 C8y C 26.9495 -18.6899
16 C1y C 24.5698 -14.4203
17 C8x C 26.9847 -20.0839
18 C1x C 23.3741 -13.6970
19 N1y N 25.8005 -13.7553
20 C1x C 23.4033 -12.2973
21 C1x C 25.8355 -12.3497
22 C1x C 24.6398 -11.6264
23 S4a S 28.1646 -17.9938
24 C1a C 29.3546 -18.6863
25 O3c O 28.1400 -16.5900
26 C1a C 27.0310 -14.5095
BOND 29
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 2
10 5 11 1
11 6 12 1
12 8 13 2
13 10 14 1
14 11 15 2
15 12 16 1
16 14 17 2
17 16 18 1
18 16 19 1
19 18 20 1
20 19 21 1
21 20 22 1
22 7 10 1
23 9 13 1
24 15 17 1
25 21 22 1
26 15 23 1
27 23 24 1
28 23 25 2
29 19 26 1
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