ATOM 18
1 C8x C 31.6144 -26.2987
2 C8y C 31.6144 -27.6975
3 C8x C 32.8034 -28.3970
4 C8y C 33.9924 -27.6975
5 C8y C 33.9924 -26.2987
6 C8x C 32.8034 -25.6692
7 C2b C 35.1815 -28.3970
8 C2b C 36.4404 -27.6975
9 C5a C 36.4404 -26.2987
10 O1a O 35.1815 -25.6692
11 S4a S 30.4253 -28.3970
12 O1d O 29.5860 -27.2079
13 O1d O 31.3346 -29.5860
14 O1d O 29.0964 -29.0265
15 C6a C 37.6529 -25.5987
16 O6a O 38.8799 -26.3069
17 O6a O 37.6529 -24.2200
18 O5a O 37.4304 -27.2886
BOND 18
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 4 7 1
8 7 8 2
9 8 9 1
10 5 10 1
11 2 11 1
12 11 12 2
13 11 13 2
14 11 14 1
15 9 15 1
16 15 16 2
17 15 17 1
18 9 18 2
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