ATOM 21
1 C8y C 28.9100 -32.9700
2 C8x C 28.9100 -34.3700
3 C8x C 30.1000 -35.0700
4 C8y C 31.3600 -34.3700
5 C8y C 31.3600 -32.9700
6 C8x C 30.1000 -32.2700
7 C1y C 32.5500 -35.0700
8 C1y C 33.7400 -34.3700
9 C1x C 33.7400 -32.9700
10 O2x O 32.5500 -32.2700
11 O2x O 32.8300 -36.4700
12 C8y C 34.2300 -36.6100
13 C8y C 34.7900 -35.2800
14 C8x C 35.0700 -37.7300
15 C8y C 36.4700 -37.5900
16 C8y C 37.0300 -36.2600
17 C8x C 36.1900 -35.1400
18 O2x O 37.5200 -38.5000
19 C1x C 38.7100 -37.8000
20 O2x O 38.4300 -36.4700
21 O1a O 27.7200 -32.2700
BOND 25
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 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 7 11 1
13 11 12 1
14 12 13 1
15 8 13 1
16 12 14 2
17 14 15 1
18 15 16 2
19 16 17 1
20 13 17 2
21 15 18 1
22 18 19 1
23 19 20 1
24 16 20 1
25 1 21 1
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