ATOM 22
1 C8x C 14.6300 -15.5400
2 C8y C 14.6300 -16.9400
3 C8x C 15.8200 -17.6400
4 C8y C 17.0800 -16.9400
5 C8x C 17.0800 -15.5400
6 C8x C 15.8200 -14.8400
7 C1b C 18.2700 -17.6400
8 C1y C 19.5300 -16.9400
9 C7x C 19.1100 -15.6100
10 C1y C 20.9300 -16.9400
11 C1x C 21.3500 -15.6100
12 O7x O 20.2300 -14.7700
13 C1b C 22.1424 -17.6400
14 C8y C 23.3549 -16.9400
15 C8x C 24.5860 -17.6510
16 C8y C 25.7985 -16.9512
17 C8x C 25.7987 -15.5512
18 C8x C 24.5676 -14.8402
19 C8x C 23.3551 -15.5400
20 O6a O 17.7770 -15.1820
21 O1a O 13.4147 -17.6351
22 O1a O 27.0292 -17.6624
BOND 24
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 8 7 1 #Down
9 9 8 1
10 8 10 1
11 10 11 1
12 11 12 1
13 9 12 1
14 10 13 1 #Up
15 13 14 1
16 14 15 2
17 15 16 1
18 16 17 2
19 17 18 1
20 18 19 2
21 14 19 1
22 9 20 2
23 2 21 1
24 16 22 1
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