ATOM 22
1 C1y C 20.4400 -18.3400
2 C2x C 20.4400 -19.7400
3 C2x C 19.2500 -20.4400
4 C1y C 17.9900 -19.7400
5 C1y C 17.9900 -18.3400
6 C1y C 19.2500 -17.6400
7 C1x C 16.8000 -20.4400
8 C1y C 15.6100 -19.7400
9 C1x C 15.6100 -18.3400
10 C1x C 16.8000 -17.6400
11 C1a C 14.4200 -20.4400
12 C1a C 21.6300 -17.6400
13 C1b C 19.2500 -16.1700
14 C1b C 20.4400 -15.4700
15 C1y C 20.4400 -14.0700
16 C1x C 19.2500 -13.3700
17 C1y C 19.2500 -11.9700
18 C1x C 20.4400 -11.2700
19 C7x C 21.7000 -11.9700
20 O7x O 21.7000 -13.3700
21 O6a O 22.8900 -11.2700
22 O1a O 18.0600 -11.2700
BOND 24
1 1 2 1
2 2 3 2
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 8 11 1 #Down
13 1 12 1 #Up
14 6 13 1 #Up
15 13 14 1
16 15 14 1 #Down
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 19 20 1
22 15 20 1
23 19 21 2
24 17 22 1 #Up
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