ATOM 23
1 C2y C 32.5500 -18.5500
2 C8y C 31.7100 -17.4300
3 C8y C 32.0600 -16.1700
4 N1y N 33.3200 -15.6100
5 N2x N 33.8800 -18.5500
6 C5x C 34.5100 -16.2400
7 C1x C 34.7900 -17.5000
8 C8x C 31.0100 -15.1900
9 C8x C 29.7500 -15.6100
10 C8y C 29.4000 -16.9400
11 C8x C 30.4500 -17.8500
12 O5x O 35.5600 -15.2600
13 X Cl 28.0700 -17.2900
14 C8y C 31.9200 -19.8100
15 C8x C 30.5200 -19.8100
16 C1b C 33.3200 -14.2100
17 C1y C 34.4400 -13.5800
18 C8x C 29.8900 -20.9300
19 C8x C 30.5200 -22.1900
20 C8x C 31.9200 -22.1900
21 C8x C 32.6200 -20.9300
22 C1x C 36.1200 -13.5800
23 C1x C 35.2800 -12.1100
BOND 26
1 3 4 1
2 1 5 2
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 6 12 2
14 10 13 1
15 1 14 1
16 14 15 1
17 4 16 1
18 16 17 1
19 15 18 2
20 18 19 1
21 19 20 2
22 20 21 1
23 14 21 2
24 17 22 1
25 17 23 1
26 22 23 1
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