ATOM 17
1 C1y C 27.2015 -17.1520
2 C1y C 27.6586 -16.1594
3 C2y C 28.5708 -17.6420
4 C1y C 25.7709 -17.6410
5 C1z C 27.6305 -18.3038
6 C2y C 29.1585 -18.8620
7 C4a C 29.7575 -16.9517
8 C1x C 25.4679 -19.4982
9 C1c C 24.3658 -18.3211
10 C1x C 26.4104 -18.6254
11 C1a C 28.3738 -19.7030
12 C1a C 30.2483 -19.4849
13 O4a O 30.9444 -17.6364
14 C1a C 23.1791 -17.6250
15 C1a C 24.3544 -19.6960
16 C1b C 28.6975 -15.5346
17 O1a O 28.6853 -14.1696
BOND 18
1 1 4 1
2 2 5 1
3 3 6 2
4 3 7 1
5 4 8 1
6 4 9 1
7 5 10 1
8 5 11 1
9 6 12 1
10 7 13 2
11 9 14 1
12 9 15 1
13 5 6 1
14 8 10 1
15 1 2 1
16 2 16 1
17 1 3 1
18 16 17 1
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