ATOM 18
1 C8y C 25.1714 -17.7024
2 C8x C 25.1714 -19.0805
3 C8x C 23.9765 -17.0132
4 C8x C 23.9765 -19.7759
5 C8x C 22.7944 -17.7024
6 C8y C 22.7944 -19.0741
7 O2a O 21.5996 -19.7759
8 S4a S 20.2213 -19.8395
9 O1d O 20.2277 -18.4613
10 O1d O 18.8494 -19.8395
11 O1d O 20.2151 -21.2114
12 C1b C 26.4124 -17.0100
13 C1c C 27.6249 -17.7100
14 C7a C 28.8373 -17.0100
15 O7a O 30.0497 -17.7100
16 C1a C 31.2622 -17.0100
17 O6a O 28.8373 -15.6100
18 N1a N 27.6249 -19.1098
BOND 18
1 1 2 1
2 1 3 2
3 2 4 2
4 3 5 1
5 4 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 8 10 2
10 8 11 2
11 5 6 2
12 1 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 14 17 2
18 13 18 1 #Up
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