ATOM 18
1 C1y C 27.0044 -16.6922
2 C2y C 25.8397 -16.0250
3 C1y C 28.1687 -16.0250
4 C1z C 25.8397 -14.6906
5 C2y C 24.6813 -16.6983
6 C1x C 28.1568 -14.6784
7 C1x C 26.9922 -14.0113
8 C2x C 24.6813 -14.0294
9 C1a C 25.8216 -13.2298
10 C5x C 23.5348 -16.0250
11 C1a C 24.6751 -18.0839
12 C2x C 23.5348 -14.6906
13 O5x O 22.3945 -16.6741
14 O7x O 27.4192 -18.0057
15 C7x C 28.6133 -18.0103
16 C1y C 29.1631 -16.8561
17 O6a O 29.3048 -19.2166
18 C1a C 30.5534 -16.5522
BOND 20
1 1 2 1
2 1 3 1
3 2 4 1
4 2 5 2
5 3 6 1
6 4 7 1
7 4 8 1
8 4 9 1 #Up
9 5 10 1
10 5 11 1
11 8 12 2
12 10 13 2
13 6 7 1
14 10 12 1
15 1 14 1
16 14 15 1
17 15 16 1
18 3 16 1
19 15 17 2
20 16 18 1 #Down
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