ATOM 22
1 C8y C 32.5500 -16.5200
2 C8y C 32.5500 -15.1200
3 C8x C 31.3600 -17.2900
4 C8x C 33.8100 -17.2200
5 C8x C 31.2900 -14.4900
6 O7x O 33.6700 -14.4200
7 C8y C 30.1000 -16.5900
8 C8x C 35.0000 -16.4500
9 C8y C 30.1000 -15.1900
10 C8y C 35.0000 -15.0500
11 C1b C 28.9100 -17.3600
12 O1a O 28.8400 -14.5600
13 O6a O 36.1200 -14.3500
14 C2b C 27.7200 -16.6600
15 C2c C 26.5300 -17.4300
16 C1b C 25.2700 -16.7300
17 C1a C 26.5300 -18.8300
18 C1b C 24.0800 -17.5000
19 C2b C 22.8200 -16.8000
20 C2c C 21.6300 -17.5700
21 C1a C 20.4400 -16.8700
22 C1a C 21.6300 -18.9700
BOND 23
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 4 8 2
8 5 9 2
9 6 10 1
10 7 11 1
11 9 12 1
12 10 13 2
13 11 14 1
14 14 15 2
15 15 16 1
16 15 17 1
17 16 18 1
18 18 19 1
19 19 20 2
20 20 21 1
21 20 22 1
22 7 9 1
23 8 10 1
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