ATOM 12
1 C1z C 20.1041 -17.7145
2 C2y C 20.5078 -19.0851
3 C2x C 21.9077 -19.1107
4 C7x C 22.3693 -17.7558
5 O7x O 21.2546 -16.8929
6 O6a O 23.7311 -17.3462
7 O2a O 19.6477 -20.2129
8 C1a C 18.2833 -20.0377
9 C2c C 18.7666 -17.2532
10 O1a O 19.0867 -18.9665
11 C1a C 17.7222 -18.1596
12 C2a C 18.4940 -15.8455
BOND 12
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 1
5 1 5 1
6 4 6 2
7 2 7 1
8 7 8 1
9 1 9 1
10 1 10 1
11 9 11 1
12 9 12 2
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