ATOM 27
1 C8x C 11.9685 -15.4681
2 C8y C 11.9685 -16.8679
3 C8x C 13.1808 -17.5677
4 C8y C 14.3931 -16.8679
5 C8y C 14.3931 -15.4681
6 C8y C 13.1808 -14.7681
7 C5x C 15.6054 -17.5677
8 C8y C 16.8176 -16.8679
9 C8y C 16.8176 -15.4681
10 C5x C 15.6054 -14.7681
11 C8x C 18.0300 -17.5677
12 C8y C 19.2422 -16.8679
13 C8y C 19.2422 -15.4681
14 C8y C 18.0300 -14.7681
15 O5x O 15.6054 -13.3683
16 O5x O 15.6054 -18.9676
17 O1a O 13.1808 -13.3685
18 O1a O 10.7563 -17.5677
19 O1a O 18.0300 -13.3686
20 O2x O 20.4546 -17.5679
21 C1y C 20.4546 -14.7681
22 C1z C 21.6671 -16.8681
23 C1x C 22.8795 -16.1681
24 C1x C 22.8795 -14.7681
25 C1x C 21.6671 -14.0681
26 O2x O 21.6671 -15.4681
27 C1a C 22.8795 -17.5681
BOND 31
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 4 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 5 10 1
12 8 11 1
13 11 12 2
14 12 13 1
15 13 14 2
16 9 14 1
17 10 15 2
18 7 16 2
19 6 17 1
20 2 18 1
21 14 19 1
22 12 20 1
23 13 21 1
24 22 23 1 #Down
25 23 24 1
26 24 25 1
27 21 25 1 #Down
28 22 20 1
29 21 26 1 #Up
30 22 26 1 #Up
31 22 27 1
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