 ATOM 27
1 C1y C 18.4149 -16.4208
2 C5x C 18.4149 -17.8241
3 C1x C 19.7481 -18.2451
4 C1y C 20.5900 -17.1225
5 C1y C 19.7481 -15.9998
6 C1b C 17.2221 -15.7192
7 C1b C 15.9592 -16.4208
8 O5x O 17.2221 -18.5258
9 O2x O 21.9933 -17.1225
10 C1z C 22.6950 -15.9297
11 C1x C 21.9933 -14.7369
12 C1x C 20.5900 -14.7369
13 C1b C 14.7664 -15.7192
14 C1b C 13.5034 -16.4208
15 C1b C 12.3808 -15.7192
16 C1b C 11.1880 -16.4208
17 C6a C 9.9952 -15.7192
18 O6a O 8.8024 -16.4208
19 O6a O 9.9952 -14.3159
20 O1a O 23.6773 -16.9120
21 C1d C 23.6773 -14.8772
22 C1b C 24.8701 -15.5789
23 C1b C 26.0629 -14.8772
24 C1b C 27.3258 -15.5789
25 C1a C 28.5186 -14.8772
26 X F 24.6596 -13.8949
27 X F 22.6950 -13.8949
BOND 28
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 1 5 1
6 1 6 1 #Down
7 6 7 1
8 2 8 2
9 4 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 5 1
14 7 13 1
15 13 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 17 19 2
21 10 20 1 #Up
22 10 21 1 #Down
23 21 22 1
24 22 23 1
25 23 24 1
26 24 25 1
27 21 26 1
28 21 27 1
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