ATOM 19
1 C1z C 29.8838 -19.2155
2 C1y C 28.6714 -19.9151
3 O2x O 29.8897 -20.6146
4 C5x C 29.8897 -17.8167
5 C2c C 31.0905 -19.9093
6 C1z C 27.4531 -19.2098
7 C2x C 28.6772 -17.1055
8 O5x O 31.1080 -17.1172
9 C2a C 32.3030 -19.2155
10 C1b C 31.0905 -21.3141
11 C2y C 27.4590 -17.8050
12 C1y C 26.2524 -19.9034
13 C1a C 27.4415 -20.6029
14 C1x C 26.2524 -17.0996
15 C1y C 25.0341 -19.2098
16 C1a C 26.2524 -21.3083
17 C1x C 25.0341 -17.8050
18 O1a O 23.8274 -19.9034
19 O1a O 32.2983 -22.0114
BOND 21
1 1 2 1
2 1 3 1
3 1 4 1
4 1 5 1 #Up
5 2 6 1
6 4 7 1
7 4 8 2
8 5 9 2
9 5 10 1
10 6 11 1
11 6 12 1
12 6 13 1 #Up
13 11 14 1
14 12 15 1
15 12 16 1 #Up
16 14 17 1
17 15 18 1 #Down
18 2 3 1
19 7 11 2
20 15 17 1
21 10 19 1
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