ATOM 22
1 C8y C 20.9300 -21.1400
2 C8y C 20.9300 -19.7400
3 C8x C 22.1200 -19.0400
4 C8x C 23.3800 -19.7400
5 C8y C 23.3800 -21.1400
6 C8x C 22.1200 -21.8400
7 C1b C 24.5700 -21.8400
8 N1b N 25.8300 -21.1400
9 C5a C 27.0200 -21.8400
10 C1b C 28.2100 -21.1400
11 C1b C 29.4000 -21.8400
12 C1b C 30.6600 -21.1400
13 C1b C 31.8500 -21.8400
14 C1b C 33.0400 -21.1400
15 C1b C 34.3000 -21.8400
16 C1c C 35.4900 -21.1400
17 O5a O 27.0200 -23.2400
18 O2a O 19.7400 -21.8400
19 C1a C 18.4800 -21.1400
20 O1a O 19.7400 -19.0400
21 C1a C 36.6800 -21.8400
22 C1a C 35.4900 -19.7400
BOND 22
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 9 17 2
18 1 18 1
19 18 19 1
20 2 20 1
21 16 21 1
22 16 22 1
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