ATOM 13
1 C8x C 22.5980 -26.2370
2 C8x C 22.5980 -27.6362
3 C8x C 23.8097 -28.3358
4 C8x C 25.0214 -27.6362
5 C8y C 25.0214 -26.2370
6 C8x C 23.8097 -25.5374
7 C1b C 26.2582 -25.5374
8 C1b C 27.4700 -26.2370
9 C1b C 28.6817 -25.5374
10 O7a O 29.8933 -26.2370
11 C7a C 31.1051 -25.5374
12 C1a C 32.3168 -26.2370
13 O6a O 31.1051 -24.1386
BOND 13
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 11 13 2
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