ATOM 27
1 C1y C 27.5680 -24.4689
2 C1z C 26.8611 -23.2532
3 C1y C 26.1650 -24.4804
4 C8y C 32.4050 -24.4746
5 C1b C 31.1937 -23.7692
6 O7a O 29.9851 -24.4689
7 C7a C 28.7765 -23.7692
8 C2b C 24.9528 -23.7763
9 C2c C 23.7443 -24.4760
10 C1d C 22.5357 -23.7763
11 X Cl 23.7373 -25.8754
12 C1a C 26.1545 -22.0376
13 C1a C 27.5539 -22.0376
14 O6a O 28.7694 -22.3697
15 C8y C 32.4050 -25.8740
16 C8y C 33.6199 -26.5737
17 C8y C 34.8276 -25.8740
18 C8y C 34.8276 -24.4746
19 C8y C 33.6199 -23.7749
20 X F 33.6065 -22.3755
21 X F 36.0308 -23.7678
22 C1a C 36.0308 -26.5737
23 X F 33.6065 -27.9732
24 X F 31.1893 -26.5666
25 X F 21.3157 -24.4675
26 X F 22.5243 -22.3755
27 X F 21.3157 -23.0752
BOND 28
1 6 7 1
2 7 14 2
3 7 1 1
4 3 8 1
5 1 2 1
6 8 9 2
7 4 15 2
8 15 16 1
9 16 17 2
10 17 18 1
11 18 19 2
12 19 4 1
13 4 5 1
14 19 20 1
15 9 10 1
16 18 21 1
17 1 3 1
18 17 22 1
19 9 11 1
20 16 23 1
21 5 6 1
22 15 24 1
23 2 12 1
24 10 25 1
25 3 2 1
26 10 26 1
27 2 13 1
28 10 27 1
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