ATOM 23
1 C8x C 14.2800 -17.6400
2 C8y C 14.2800 -19.0400
3 C8y C 15.4924 -19.7400
4 C8y C 16.7049 -19.0400
5 C8x C 16.7049 -17.6400
6 C8y C 15.4924 -16.9400
7 S4a S 15.4924 -15.5400
8 N1a N 15.4924 -14.1400
9 O3c O 16.8924 -15.5400
10 O3c O 14.0924 -15.5400
11 N2b N 17.9360 -19.7510 #+
12 O3a O 19.4212 -19.0553 #-
13 O3a O 17.9357 -21.1399
14 N2b N 13.0676 -19.7400 #+
15 O3a O 11.8721 -19.0496 #-
16 O3a O 13.0675 -21.1398
17 N1c N 15.4924 -21.1398
18 C1b C 14.2632 -21.8497
19 C1b C 16.6880 -21.8302
20 C1b C 14.2632 -23.2497
21 C1b C 16.6880 -23.2302
22 C1a C 13.0676 -23.9400
23 C1a C 17.8834 -23.9206
BOND 23
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 6 7 1
8 7 8 1
9 7 9 2
10 7 10 2
11 4 11 1
12 11 12 1
13 11 13 2
14 2 14 1
15 14 15 1
16 14 16 2
17 3 17 1
18 17 18 1
19 17 19 1
20 18 20 1
21 19 21 1
22 20 22 1
23 21 23 1
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