ATOM 16
1 C1y C 25.4755 -18.0596
2 C1z C 25.4814 -16.6617
3 C1x C 26.6813 -18.7703
4 C2y C 24.2696 -18.7646
5 C1x C 26.6989 -15.9684
6 C1x C 24.2696 -15.9627
7 C1a C 25.4638 -15.2578
8 C1y C 27.8988 -18.0713
9 C2x C 23.0523 -18.0596
10 C1a C 24.2696 -20.1684
11 C1x C 27.9047 -16.6732
12 C1x C 23.0523 -16.6617
13 C1d C 29.1046 -18.7820
14 C1a C 29.0989 -20.1801
15 C1a C 30.3221 -18.0830
16 O1a O 30.3104 -19.4753
BOND 17
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 2 7 1 #Up
7 3 8 1
8 4 9 2
9 4 10 1
10 5 11 1
11 6 12 1
12 8 13 1 #Up
13 13 14 1
14 13 15 1
15 13 16 1
16 8 11 1
17 9 12 1
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