ATOM 25
1 C1z C 18.5803 -15.8982
2 C1z C 19.7216 -16.5712
3 C8y C 18.5803 -14.5814
4 C1x C 17.4391 -16.5480
5 C1x C 19.7216 -15.2251
6 C2y C 19.7098 -17.8881
7 C1x C 20.8687 -15.9099
8 N1x N 22.1970 -16.5421
9 C8y C 19.7275 -13.9258
10 C8y C 17.4332 -13.9258
11 C5x C 17.4274 -17.8707
12 C1x C 22.1915 -15.2836
13 C2y C 18.5629 -18.5319
14 O2a O 20.8453 -18.5437
15 C1x C 20.8745 -14.5814
16 C8x C 19.7275 -12.5914
17 C8y C 17.4332 -12.5914
18 O1a O 16.2802 -14.5814
19 O5x O 16.2744 -18.5261
20 O2a O 18.5569 -19.8488
21 C1a C 20.8394 -19.8722
22 C8x C 18.5861 -11.9302
23 O2a O 16.2861 -11.9302
24 C1a C 19.7041 -20.5160
25 C1a C 15.1390 -12.5857
BOND 28
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Down
5 2 6 1
6 2 7 1
7 2 8 1 #Down
8 3 9 2
9 3 10 1
10 4 11 1
11 5 12 1
12 6 13 2
13 6 14 1
14 7 15 1
15 9 16 1
16 10 17 2
17 10 18 1
18 11 19 2
19 13 20 1
20 14 21 1
21 16 22 2
22 17 23 1
23 20 24 1
24 23 25 1
25 8 12 1
26 9 15 1
27 11 13 1
28 17 22 1
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