ATOM 21
1 C1x C 23.4500 -16.8700
2 C1x C 23.4500 -18.2000
3 C1x C 24.6400 -18.9000
4 C1y C 25.8300 -18.2000
5 C1z C 25.8300 -16.8700
6 C1x C 24.6400 -16.1700
7 C1x C 27.0200 -18.9000
8 C1x C 28.1400 -18.2000
9 C1y C 28.1400 -16.8700
10 C1y C 27.0200 -16.1700
11 C1z C 29.3300 -16.1700
12 C1z C 29.3300 -14.7700
13 C1x C 28.1400 -14.1400
14 C1x C 27.0200 -14.7700
15 C1x C 31.7100 -16.1700
16 C1x C 31.7100 -14.7700
17 C1x C 30.5200 -14.1400
18 C1a C 25.8300 -15.4700
19 C1a C 29.3300 -13.4400
20 C4a C 29.6100 -17.5000
21 O4a O 30.8224 -18.2000
BOND 24
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 5 18 1
22 12 19 1
23 11 20 1 #Down
24 20 21 2
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