ATOM 13
1 C8y C 25.4956 -18.9610
2 C1b C 26.7066 -19.6630
3 C8x C 24.2202 -19.5227
4 N5x N 25.3493 -17.5627
5 C1b C 27.9235 -18.9610
6 N4x N 23.2840 -18.4813
7 C8x C 23.9803 -17.2702
8 C1b C 29.1354 -19.6612
9 N1b N 30.3479 -18.9616
10 C2c C 31.5600 -19.6619
11 N1b N 32.7724 -18.9623
12 S0 S 31.5595 -21.0700
13 C1a C 33.9786 -19.6593
BOND 13
1 3 6 1
2 4 7 2
3 6 7 1
4 5 8 1
5 1 2 1
6 8 9 1
7 1 3 2
8 9 10 1
9 1 4 1
10 10 11 1
11 2 5 1
12 10 12 2
13 11 13 1
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