ATOM 17
1 C1x C 32.0133 -22.7941
2 C1x C 32.0133 -24.1819
3 C1y C 33.2151 -24.8758
4 C5x C 34.4170 -24.1819
5 C2y C 34.4170 -22.7941
6 C2x C 33.2151 -22.1003
7 C1x C 35.6188 -24.8758
8 C8y C 36.8206 -24.1819
9 C8y C 36.8206 -22.7941
10 C1x C 35.6188 -22.1003
11 C8y C 38.1405 -24.6107
12 C8x C 38.9562 -23.4880
13 O2x O 38.1405 -22.3653
14 O5x O 34.4170 -25.5697
15 C1a C 34.4170 -21.4064
16 C1a C 33.2151 -26.4717
17 C1a C 38.5826 -25.9715
BOND 18
1 1 2 1
2 2 3 1
3 3 4 1
4 5 6 2
5 1 6 1
6 4 7 1
7 7 8 1
8 8 9 2
9 9 10 1
10 5 10 1
11 8 11 1
12 11 12 2
13 12 13 1
14 9 13 1
15 4 14 2
16 5 15 1
17 3 16 1 #Up
18 11 17 1
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