ATOM 19
1 C8x C 9.3100 -16.5200
2 C8x C 9.3100 -17.9200
3 C8y C 10.5224 -18.6200
4 C8y C 11.7349 -17.9200
5 C8x C 11.7349 -16.5200
6 C8y C 10.5224 -15.8200
7 O1a O 10.5224 -14.4202
8 O1a O 10.5224 -20.0198
9 C1y C 12.9660 -18.6310
10 C2x C 14.1712 -17.9353
11 C2y C 14.1712 -16.5353
12 C1b C 15.3664 -15.8448
13 C1x C 12.9286 -15.8181
14 C1b C 16.5928 -16.5529
15 C2b C 16.5928 -17.9529
16 C2c C 17.8052 -18.6529
17 C1a C 19.0124 -17.9557
18 C1a C 17.8047 -20.0198
19 O2x O 12.5663 -17.1704
BOND 20
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 6 7 1
8 3 8 1
9 4 9 1
10 9 10 1
11 10 11 2
12 11 12 1
13 11 13 1
14 12 14 1
15 14 15 1
16 15 16 2
17 16 17 1
18 16 18 1
19 13 19 1
20 19 9 1
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