ATOM 17
1 C8x C 21.3959 -15.0980
2 C8x C 21.3959 -16.5000
3 C8x C 22.6137 -17.2045
4 C8x C 22.6137 -14.4006
5 C8y C 23.8175 -15.0980
6 C8y C 23.8116 -16.5000
7 N4y N 25.0237 -17.2096
8 C8y C 26.2417 -16.5103
9 C8y C 26.2477 -15.1083
10 C8y C 25.0356 -14.4058
11 C1b C 27.4473 -17.2114
12 C1b C 28.6590 -16.5071
13 C1a C 29.8708 -17.2114
14 C1a C 25.0099 -18.6063
15 O2a O 27.4544 -14.4148
16 C1a C 28.6661 -15.1122
17 O5x O 25.0939 -12.9987
BOND 18
1 6 7 1
2 7 8 1
3 8 9 2
4 9 10 1
5 10 5 1
6 8 11 1
7 1 2 1
8 11 12 1
9 2 3 2
10 12 13 1
11 3 6 1
12 7 14 1
13 5 4 1
14 9 15 1
15 4 1 2
16 15 16 1
17 5 6 2
18 10 17 2
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