ATOM 24
1 C1y C 22.6283 -15.9293
2 C1y C 23.5059 -17.0260
3 C1z C 22.9345 -14.5568
4 O2x O 21.5962 -14.9841
5 C1y C 24.9079 -17.0405
6 O7x O 23.0566 -18.3586
7 C1x C 24.2149 -13.9478
8 C1a C 21.8876 -13.6373
9 C1y C 25.7862 -15.9344
10 C2y C 25.3313 -18.3834
11 C7x C 24.1848 -19.1940
12 C1x C 24.4046 -12.5665
13 C1x C 25.4725 -14.5634
14 O7a O 27.1028 -16.7483
15 C2a C 26.6553 -18.8251
16 O6a O 24.1694 -20.5878
17 C1y C 25.7765 -12.3230
18 C2y C 26.4397 -13.5501
19 C7a C 28.3236 -16.0730
20 O2a O 26.3837 -11.0660
21 C2a C 27.6838 -13.5946
22 C1a C 29.5105 -16.7908
23 O6a O 28.3456 -14.6797
24 O1a O 27.7161 -10.6105
BOND 26
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 1 #Up
8 5 9 1
9 5 10 1
10 6 11 1
11 7 12 1
12 9 13 1
13 9 14 1 #Up
14 10 15 2
15 11 16 2
16 12 17 1
17 13 18 1
18 14 19 1
19 17 20 1 #Up
20 18 21 2
21 19 22 1
22 19 23 2
23 20 24 1
24 3 4 1
25 10 11 1
26 17 18 1
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