ATOM 20
1 C8y C 26.2391 -19.2093
2 C8y C 26.2332 -20.6085
3 C5x C 27.4576 -18.5098
4 C8y C 25.0263 -18.5039
5 C5x C 27.4459 -21.3081
6 C8x C 25.0263 -21.3081
7 C2y C 28.6644 -19.2152
8 O5x O 27.4633 -17.1047
9 C8x C 23.8138 -19.2093
10 O2a O 25.0323 -17.0989
11 C2y C 28.6528 -20.6144
12 O5x O 27.4459 -22.7133
13 C8x C 23.8138 -20.6085
14 C1y C 29.8827 -18.5272
15 C1a C 23.8195 -16.3993
16 C1x C 29.8537 -21.3198
17 O2x O 31.0838 -19.2385
18 C1a C 29.8944 -17.1223
19 C1y C 31.0722 -20.6378
20 C1a C 32.2847 -21.3431
BOND 22
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 2
9 4 10 1
10 5 11 1
11 5 12 2
12 6 13 2
13 7 14 1
14 10 15 1
15 11 16 1
16 14 17 1
17 14 18 1 #Up
18 16 19 1
19 19 20 1 #Up
20 7 11 2
21 9 13 1
22 17 19 1
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