ATOM 20
1 C8x C 25.6240 -18.1024
2 C8x C 24.4081 -18.7950
3 C8x C 24.4002 -20.1942
4 C8y C 25.6079 -20.9008
5 C8y C 26.8317 -18.8089
6 C8y C 26.8221 -20.2048
7 N5x N 28.0262 -20.9110
8 N5x N 28.0453 -18.1192
9 C8y C 29.2494 -18.8254
10 C8y C 29.2368 -20.2191
11 C8x C 30.4376 -20.9269
12 C8x C 31.6509 -20.2410
13 C8x C 31.6636 -18.8473
14 C8y C 30.4629 -18.1395
15 C1c C 30.4757 -16.7292
16 O1a O 31.7034 -16.0350
17 C1a C 29.2606 -16.0129
18 C6a C 25.6016 -22.3112
19 O6a O 24.3769 -23.0110
20 O6a O 26.8200 -23.0219
BOND 22
1 1 2 2
2 2 3 1
3 3 4 2
4 4 6 1
5 5 1 1
6 5 6 1
7 6 7 2
8 7 10 1
9 9 8 1
10 8 5 2
11 9 10 2
12 10 11 1
13 11 12 2
14 12 13 1
15 13 14 2
16 14 9 1
17 14 15 1
18 15 16 1 #Up
19 15 17 1
20 4 18 1
21 18 19 2
22 18 20 1
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