ATOM 19
1 C1a C 12.6700 -17.7800
2 C1b C 13.8824 -17.0800
3 O7a O 15.0949 -17.7800
4 C7a C 16.3073 -17.0800
5 N1c N 17.5197 -17.7800
6 C5a C 18.7322 -17.0800
7 C1b C 19.9446 -17.7800
8 O6a O 16.3073 -15.6800
9 O5a O 18.7322 -15.6803
10 C1a C 17.5197 -19.1799
11 S2a S 21.1611 -17.0777
12 P1a P 22.3586 -17.7692
13 O2b O 23.5710 -18.4692
14 S0 S 21.4371 -19.0021
15 O2b O 23.1165 -16.4372
16 C1b C 24.4999 -16.4371
17 C1a C 25.1943 -15.2343
18 C1b C 23.5709 -19.8799
19 C1a C 24.7976 -20.5883
BOND 18
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 4 8 2
8 6 9 2
9 5 10 1
10 7 11 1
11 11 12 1
12 12 13 1
13 12 14 2
14 12 15 1
15 15 16 1
16 16 17 1
17 13 18 1
18 18 19 1
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