ATOM 24
1 C1y C 28.1070 -20.5833
2 C1y C 26.8960 -21.2794
3 C8y C 28.1128 -19.1792
4 C1x C 29.3179 -21.2794
5 C1b C 25.6850 -20.5833
6 C1x C 26.8960 -22.6835
7 C8x C 29.3238 -18.4830
8 C8x C 26.9018 -18.4830
9 C1x C 29.3179 -22.6835
10 O2a O 24.4681 -21.2794
11 N1x N 28.1070 -23.3796
12 C8x C 29.3238 -17.0848
13 C8x C 26.9018 -17.0790
14 C8y C 23.2571 -20.5774
15 C8y C 28.1128 -16.3828
16 C8x C 23.2630 -19.1850
17 C8x C 22.0520 -21.2853
18 X F 28.1187 -14.9846
19 C8y C 22.0578 -18.4830
20 C8x C 20.8410 -20.5833
21 C8y C 20.8410 -19.1850
22 O2x O 21.7712 -17.1082
23 O2x O 19.7996 -18.2432
24 C1x C 20.3729 -16.9560
BOND 27
1 1 2 1
2 1 3 1 #Down
3 1 4 1
4 2 5 1 #Up
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 1
9 5 10 1
10 6 11 1
11 7 12 1
12 8 13 2
13 10 14 1
14 12 15 2
15 14 16 2
16 14 17 1
17 15 18 1
18 16 19 1
19 17 20 2
20 19 21 2
21 19 22 1
22 21 23 1
23 22 24 1
24 9 11 1
25 13 15 1
26 20 21 1
27 23 24 1
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