ATOM 30
1 X Cl 36.1188 -15.8819
2 O0 O 36.3785 -13.4405
3 C8x C 20.8600 -16.1700
4 C8x C 20.8600 -17.5700
5 C8x C 22.0724 -18.2700
6 C8x C 23.2849 -17.5700
7 C8y C 23.2849 -16.1700
8 C8x C 22.0724 -15.4700
9 C1x C 25.7097 -17.5700
10 C1y C 25.7097 -16.1700
11 C1d C 24.4973 -15.4700
12 C1x C 26.9222 -18.2700
13 C1x C 28.1346 -17.5700
14 C1x C 28.1346 -16.1700
15 C1x C 26.9222 -15.4700
16 C7a C 24.4973 -14.0700
17 O1a O 23.2849 -14.7700
18 O7a O 25.7118 -13.3688
19 O6a O 23.2869 -13.3712
20 C1d C 25.7118 -11.9688
21 C1a C 25.7118 -10.5688
22 C1a C 24.2900 -11.9688
23 C3b C 27.0900 -11.9689
24 C3b C 28.4900 -11.9689
25 C1b C 29.8900 -11.9689
26 N1c N 30.5905 -13.1821
27 C1b C 31.9898 -13.1821
28 C1a C 32.6804 -14.3779
29 C1b C 29.8999 -14.3781
30 C1a C 28.4903 -14.3781
BOND 29
1 3 4 2
2 4 5 1
3 5 6 2
4 6 7 1
5 7 8 2
6 3 8 1
7 9 10 1
8 10 11 1
9 7 11 1
10 9 12 1
11 12 13 1
12 13 14 1
13 14 15 1
14 10 15 1
15 11 16 1
16 11 17 1
17 16 18 1
18 16 19 2
19 18 20 1
20 20 21 1
21 20 22 1
22 20 23 1
23 23 24 3
24 24 25 1
25 25 26 1
26 26 27 1
27 27 28 1
28 26 29 1
29 29 30 1
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