ATOM 12
1 C8y C 24.8849 -17.1915
2 C8y C 26.0967 -17.8847
3 C8y C 23.6730 -17.8847
4 C1b C 24.8674 -15.7874
5 C8x C 26.0967 -19.2830
6 C4a C 27.3087 -17.1798
7 C8y C 23.6730 -19.2830
8 O1a O 22.4553 -17.1915
9 O1a O 23.6613 -15.0823
10 N5x N 24.8849 -19.9881
11 O4a O 27.3028 -15.7815
12 C1a C 22.4553 -19.9822
BOND 12
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 5 10 2
10 6 11 2
11 7 12 1
12 7 10 1
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