ATOM 17
1 C8y C 24.5000 -18.4100
2 S4a S 25.6900 -17.7100
3 C8x C 24.5000 -19.8100
4 C8x C 23.3100 -17.7100
5 N1b N 26.9500 -18.4100
6 O3c O 24.7100 -16.6600
7 O3c O 26.7400 -16.6600
8 C8x C 23.3100 -20.5100
9 C8x C 22.1200 -18.4100
10 C8y C 28.1400 -17.7100
11 C8y C 22.1200 -19.8100
12 C8x C 29.3300 -18.4100
13 N5x N 28.4200 -16.3100
14 N1a N 20.8600 -20.5100
15 C8y C 30.3800 -17.4300
16 O2x O 29.8200 -16.1700
17 C1a C 31.7800 -17.4300
BOND 18
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 2
6 2 7 2
7 3 8 2
8 4 9 1
9 5 10 1
10 8 11 1
11 10 12 1
12 10 13 2
13 11 14 1
14 12 15 2
15 13 16 1
16 15 17 1
17 9 11 2
18 15 16 1
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