ATOM 19
1 O2b O 29.3174 -23.5782
2 C1b C 31.7342 -22.1991
3 C1a C 30.5307 -21.4915
4 P1a P 30.5138 -24.2787
5 O2b O 30.5094 -25.6722
6 C1b C 31.7151 -26.3763
7 C1a C 32.9251 -25.6798
8 O2b O 31.7240 -23.5893
9 S0 S 29.2960 -24.9741
10 C8y C 28.0902 -24.2770
11 C8x C 26.9064 -23.5839
12 C8y C 25.6905 -24.2760
13 N5x N 25.6819 -25.6750
14 C8y C 26.8657 -26.3681
15 N5x N 28.0814 -25.6760
16 C1a C 24.4752 -23.5642
17 C1c C 26.9100 -27.7895
18 C1a C 25.6321 -28.4586
19 C1a C 28.0554 -28.5206
BOND 19
1 1 4 1
2 8 2 1
3 2 3 1
4 4 5 1
5 5 6 1
6 6 7 1
7 8 4 1
8 4 9 2
9 1 10 1
10 10 11 2
11 11 12 1
12 12 13 2
13 13 14 1
14 14 15 2
15 10 15 1
16 12 16 1
17 14 17 1
18 17 18 1
19 17 19 1
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