ATOM 9
1 C1x C 19.6000 -18.0600
2 N1y N 19.6000 -19.4600
3 C1x C 20.8124 -20.1600
4 N1y N 22.0249 -19.4600
5 C2y C 22.0249 -18.0600
6 S2x S 20.8124 -17.3600
7 S0 S 23.2560 -17.3490
8 C1a C 18.3876 -20.1600
9 C1a C 23.2560 -20.1710
BOND 9
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 5 7 2
8 2 8 1
9 4 9 1
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