ATOM 17
1 C1b C 24.4599 -18.5694
2 C1b C 25.6777 -17.8662
3 C1b C 26.8957 -18.5694
4 C1d C 28.1136 -17.8662
5 C1b C 29.3315 -18.5694
6 C6a C 30.5494 -17.8662
7 C1b C 23.2420 -17.8662
8 C1b C 22.0411 -18.5597
9 C1b C 20.8469 -17.8702
10 S2a S 19.6511 -18.5606
11 C1a C 18.4561 -17.8707
12 O6a O 31.7328 -18.5495
13 O6a O 30.5497 -16.4503
14 C6a C 28.1136 -16.4662
15 O6a O 29.3529 -15.7507
16 O6a O 26.9143 -15.7735
17 O1a O 26.9011 -17.1662
BOND 16
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 6 12 1
12 6 13 2
13 4 14 1
14 14 15 2
15 14 16 1
16 4 17 1
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