ATOM 19
1 C8y C 28.5406 -19.8835
2 C8y C 27.4074 -19.1710
3 C8y C 28.5873 -21.2795
4 O2x O 29.8254 -19.2120
5 C8y C 26.1869 -19.8544
6 O2a O 27.4250 -17.7694
7 C8x C 27.3724 -21.9628
8 C2x C 29.7786 -21.9921
9 C1z C 31.0169 -19.9245
10 C8y C 26.1752 -21.2561
11 O2a O 24.9838 -19.1419
12 C1a C 28.6457 -17.0861
13 C2x C 30.9935 -21.3146
14 C1a C 32.2317 -19.2411
15 C1a C 32.2376 -20.7772
16 C5a C 24.9545 -21.9394
17 C1a C 23.7689 -19.8252
18 C1a C 23.7515 -21.2268
19 O5a O 24.9370 -23.3099
BOND 20
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 6 12 1
12 8 13 2
13 9 14 1
14 9 15 1
15 10 16 1
16 11 17 1
17 16 18 1
18 7 10 2
19 9 13 1
20 16 19 2
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