ATOM 17
1 C8x C 12.6000 -19.1100
2 C8x C 12.6000 -20.5100
3 C8x C 13.8124 -21.2100
4 C8x C 15.0249 -20.5100
5 C8y C 15.0249 -19.1100
6 C8x C 13.8124 -18.4100
7 C1b C 16.2624 -18.4100
8 C1c C 17.4749 -19.1100
9 C5a C 18.6873 -18.4100
10 N1b N 19.8997 -19.1100
11 C1b C 21.1122 -18.4100
12 C6a C 22.3246 -19.1100
13 O6a O 23.5370 -18.4100
14 C1b C 17.4749 -20.5098
15 S1a S 18.7061 -21.2208
16 O5a O 18.6873 -17.0100
17 O6a O 22.3246 -20.5100
BOND 17
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 8 14 1
15 14 15 1
16 9 16 2
17 12 17 2
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