ATOM 21
1 C8y C 24.9721 -31.9497
2 C8y C 25.0247 -33.3485
3 C5x C 23.7599 -31.2505
4 C8y C 26.1902 -31.2679
5 C5x C 23.7482 -34.0538
6 C8x C 26.1611 -34.0595
7 C8y C 22.5418 -31.9382
8 O5x O 23.6956 -29.8458
9 C8x C 27.3907 -31.9730
10 O1a O 26.2018 -29.8633
11 C8y C 22.5359 -33.3427
12 O5x O 23.7423 -35.4526
13 C8y C 27.3792 -33.3718
14 C8y C 21.3294 -31.2445
15 C8x C 21.3294 -34.0479
16 C6a C 28.5797 -34.0654
17 C8x C 20.1113 -31.9382
18 O1a O 21.3294 -29.8400
19 C8x C 20.1113 -33.3427
20 O6a O 29.7862 -33.3601
21 O6a O 28.5797 -35.4700
BOND 23
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 11 15 1
15 13 16 1
16 14 17 2
17 14 18 1
18 15 19 2
19 16 20 1
20 16 21 2
21 7 11 2
22 9 13 1
23 17 19 1
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