ATOM 24
1 C8x C 12.9500 -15.4000
2 C8x C 12.9500 -16.8000
3 C8x C 14.1624 -17.5000
4 C8y C 15.3749 -16.8000
5 C8y C 15.3749 -15.4000
6 C8x C 14.1624 -14.7000
7 N1b N 16.6060 -14.6890
8 C2c C 16.6060 -13.2890
9 N1b N 17.8024 -12.6000
10 C7a C 19.0149 -13.3000
11 O7a O 20.2273 -12.6000
12 C1b C 21.4397 -13.3000
13 C1a C 22.6522 -12.6000
14 S0 S 15.3869 -12.5841
15 O6a O 19.0149 -14.6998
16 N1b N 16.6060 -17.5110
17 C2c C 16.6060 -18.9110
18 N1b N 17.8024 -19.6000
19 C7a C 19.0149 -18.9000
20 O7a O 20.2273 -19.6000
21 C1b C 21.4397 -18.9000
22 C1a C 22.6522 -19.6000
23 S0 S 15.3869 -19.6159
24 O6a O 19.0149 -17.5002
BOND 24
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 2
15 10 15 2
16 4 16 1
17 16 17 1
18 17 18 1
19 18 19 1
20 19 20 1
21 20 21 1
22 21 22 1
23 17 23 2
24 19 24 2
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