ATOM 22
1 C1y C 20.4914 -16.3434
2 C1y C 21.6895 -17.0398
3 O2a O 19.2932 -17.4223
4 C1x C 20.4914 -14.9633
5 C1x C 22.8689 -16.3434
6 C1c C 21.6959 -18.3373
7 C1y C 17.7563 -18.0811
8 C1y C 21.6895 -14.2796
9 C1x C 22.8689 -14.9633
10 C1a C 22.8753 -19.0147
11 C1a C 20.5165 -19.0211
12 O2x O 16.5644 -17.3974
13 C1y C 17.7563 -19.4486
14 C1a C 21.6959 -12.9183
15 C1y C 15.3850 -18.0811
16 C1y C 16.5644 -20.1324
17 O1a O 18.9607 -20.4273
18 C1y C 15.3850 -19.4486
19 C1b C 14.2119 -17.3974
20 O1a O 16.5644 -21.4938
21 O1a O 14.2119 -20.1324
22 O1a O 13.1706 -18.2819
BOND 23
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 2 6 1 #Up
6 7 3 1 #Up
7 4 8 1
8 5 9 1
9 6 10 1
10 6 11 1
11 7 12 1
12 7 13 1
13 8 14 1 #Down
14 12 15 1
15 13 16 1
16 13 17 1 #Down
17 15 18 1
18 15 19 1 #Up
19 16 20 1 #Up
20 18 21 1 #Down
21 19 22 1
22 8 9 1
23 16 18 1
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