ATOM 18
1 C8y C 21.7700 -17.7800
2 S4a S 22.9600 -17.0800
3 C8x C 21.7700 -19.1800
4 C8x C 20.5800 -17.0800
5 N1b N 24.1500 -17.7800
6 O3c O 23.9400 -16.1000
7 O3c O 21.9800 -16.1000
8 C8x C 20.5800 -19.9500
9 C8x C 19.3900 -17.7800
10 C8y C 19.3900 -19.1800
11 N1a N 18.1300 -19.9500
12 C8y C 25.3681 -17.0899
13 C8y C 26.6154 -17.6574
14 N5x N 27.5406 -16.6466
15 S2x S 26.8651 -15.4543
16 N5x N 25.5225 -15.7282
17 O2a O 26.8910 -19.0094
18 C1a C 28.2178 -19.4527
BOND 19
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 2
6 2 7 2
7 3 8 1
8 4 9 2
9 8 10 2
10 10 11 1
11 9 10 1
12 5 12 1
13 12 13 1
14 13 14 2
15 14 15 1
16 15 16 1
17 12 16 2
18 13 17 1
19 17 18 1
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