ATOM 17
1 C8x C 23.4002 -20.1566
2 C8x C 23.4002 -21.5585
3 C8x C 24.6173 -22.2594
4 C8x C 24.6173 -19.4556
5 C8y C 25.8271 -20.1566
6 C8y C 25.8212 -21.5585
7 C8x C 27.0323 -22.2646
8 C8x C 27.0444 -19.4609
9 C8y C 28.2555 -20.1669
10 C8y C 28.3127 -21.5653
11 C8x C 29.4474 -22.2752
12 C8x C 30.6646 -21.5872
13 C8y C 30.6773 -20.1888
14 C8y C 29.4727 -19.4789
15 O2a O 29.4855 -18.0601
16 O1a O 31.8948 -19.5003
17 C1a C 30.6925 -17.3777
BOND 19
1 9 8 2
2 8 5 1
3 5 4 2
4 4 1 1
5 1 2 2
6 2 3 1
7 3 6 2
8 9 10 1
9 10 11 1
10 11 12 2
11 12 13 1
12 13 14 2
13 14 9 1
14 5 6 1
15 6 7 1
16 7 10 2
17 14 15 1
18 13 16 1
19 15 17 1
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