ATOM 19
1 C1z C 26.6995 -19.4655
2 C1z C 26.3089 -18.0314
3 C1y C 25.5336 -20.2468
4 C1y C 28.0170 -20.0020
5 O2x O 27.1252 -18.1656
6 C1x C 27.1309 -16.8655
7 C1x C 24.8981 -18.0606
8 C1a C 25.9358 -16.7374
9 C1x C 24.4200 -19.3781
10 C1c C 25.4870 -21.6576
11 C2x C 29.3288 -19.2441
12 O1a O 28.0987 -21.4069
13 O2x O 28.5244 -18.2064
14 C1y C 28.5475 -16.8481
15 C1a C 24.2394 -22.3222
16 C1a C 26.6821 -22.3980
17 C2y C 29.4978 -17.9091
18 C4a C 30.8503 -17.5184
19 O4a O 31.8647 -18.4921
BOND 21
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Down
5 2 6 1
6 2 7 1
7 2 8 1 #Up
8 3 9 1
9 3 10 1 #Up
10 4 11 1
11 4 12 1 #Down
12 5 13 1
13 6 14 1
14 10 15 1
15 10 16 1
16 11 17 2
17 17 18 1
18 18 19 2
19 7 9 1
20 14 13 1 #Down
21 14 17 1
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