ATOM 18
1 C1y C 23.6769 -14.5560
2 C1y C 24.5896 -15.6572
3 C2y C 23.9771 -13.1740
4 C2y C 22.2779 -14.6906
5 C1y C 25.9948 -15.7071
6 O7x O 24.1667 -17.0071
7 C5x C 22.7539 -12.4715
8 C2y C 25.2420 -12.5456
9 C2x C 21.7091 -13.4084
10 C1a C 21.5738 -15.9130
11 C1y C 26.4600 -16.9669
12 C1x C 26.8554 -14.5139
13 C7x C 25.3243 -17.8135
14 O5x O 22.6121 -11.0724
15 C1x C 26.5274 -13.1354
16 C1a C 25.2918 -11.1406
17 C1a C 27.7978 -17.3795
18 O6a O 25.3444 -19.2183
BOND 20
1 1 2 1
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 2
9 4 10 1
10 5 11 1
11 5 12 1
12 6 13 1
13 7 14 2
14 8 15 1
15 8 16 1
16 11 17 1 #Up
17 13 18 2
18 7 9 1
19 11 13 1
20 12 15 1
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