ATOM 22
1 C8x C 16.5012 -17.1639
2 C8x C 16.5012 -18.5658
3 C8x C 17.7191 -19.2704
4 C8y C 18.9231 -18.5658
5 C8x C 18.9231 -17.1639
6 C8y C 17.7191 -16.4664
7 C1b C 20.1388 -19.2696
8 C1b C 21.3483 -18.5589
9 C1b C 22.5602 -19.2633
10 C1b C 23.7721 -18.5589
11 C1b C 24.9838 -19.2633
12 C1b C 26.1957 -18.5589
13 C1b C 27.4004 -19.2633
14 C2b C 28.6123 -18.5589
15 C2b C 28.6052 -17.1568
16 C1b C 27.3866 -16.4654
17 C1b C 26.1816 -17.1568
18 C1b C 24.9698 -16.4593
19 C1b C 23.7579 -17.1568
20 C1b C 22.5462 -16.4593
21 C1a C 21.3343 -17.1568
22 O1a O 17.7210 -15.0643
BOND 22
1 10 11 1
2 5 6 2
3 11 12 1
4 6 1 1
5 12 13 1
6 13 14 1
7 4 7 1
8 14 15 2
9 1 2 2
10 15 16 1
11 7 8 1
12 16 17 1
13 2 3 1
14 17 18 1
15 8 9 1
16 18 19 1
17 3 4 2
18 19 20 1
19 9 10 1
20 20 21 1
21 4 5 1
22 6 22 1
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