ATOM 21
1 C1x C 32.4800 -19.6000
2 C8y C 31.6400 -18.4800
3 C8y C 31.9900 -17.1500
4 C1y C 33.2500 -16.5900
5 C1x C 33.8800 -19.6000
6 C1x C 34.5100 -17.2200
7 N1x N 34.7900 -18.5500
8 C8x C 30.9400 -16.1700
9 C8y C 29.5400 -16.5900
10 C8y C 29.1900 -17.9200
11 C8y C 30.3100 -18.9000
12 O1a O 27.8600 -18.3400
13 O1a O 28.5600 -15.6100
14 X Cl 29.9600 -20.3000
15 C8y C 33.2500 -15.1900
16 C8x C 34.4400 -14.4900
17 C8x C 34.4400 -13.0900
18 C8y C 33.2500 -12.3900
19 C8x C 31.9900 -13.0900
20 C8x C 31.9900 -14.4900
21 O1a O 33.2500 -10.9900
BOND 23
1 3 4 1
2 1 5 1
3 4 6 1
4 2 3 1
5 5 7 1
6 1 2 1
7 6 7 1
8 3 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 2 11 2
13 10 12 1
14 9 13 1
15 11 14 1
16 4 15 1
17 15 16 2
18 16 17 1
19 17 18 2
20 18 19 1
21 19 20 2
22 15 20 1
23 18 21 1
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