ATOM 19
1 C8y C 27.1770 -17.1506
2 C8y C 27.1653 -18.5493
3 C5x C 25.9647 -16.4512
4 C8y C 28.3950 -16.4687
5 C5x C 25.9530 -19.2544
6 C8x C 28.3717 -19.2660
7 C8y C 24.7467 -17.1447
8 O5x O 25.9706 -15.0466
9 C8y C 29.6014 -17.1739
10 O1a O 28.4067 -15.0642
11 C8y C 24.8109 -18.5434
12 O5x O 25.9530 -20.6531
13 C8y C 29.5897 -18.5724
14 C8x C 23.5462 -16.4453
15 O1a O 30.8194 -16.4862
16 C8x C 23.5462 -19.2485
17 O1a O 30.7961 -19.2894
18 C8x C 22.3282 -17.1447
19 C8x C 22.3282 -18.5434
BOND 21
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 2
9 4 10 1
10 5 11 1
11 5 12 2
12 6 13 2
13 7 14 1
14 9 15 1
15 11 16 1
16 13 17 1
17 14 18 2
18 16 19 2
19 7 11 2
20 9 13 1
21 18 19 1
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