ATOM 31
1 C1x C 7.0000 -22.4700
2 C5x C 7.0000 -23.8700
3 C1x C 8.2124 -24.5700
4 C1y C 9.4249 -23.8700
5 C1z C 9.4249 -22.4700
6 C1x C 8.2124 -21.7700
7 C1x C 10.6373 -24.5700
8 C1x C 11.8497 -23.8700
9 C1y C 11.8497 -22.4700
10 C1z C 10.6373 -21.7700
11 C1y C 13.0622 -21.7700
12 C1z C 13.0622 -20.3700
13 C1x C 11.8497 -19.6700
14 C1y C 10.6373 -20.3700
15 C1x C 15.4870 -21.7700
16 C1y C 15.4870 -20.3700
17 C1z C 14.2746 -19.6700
18 O5x O 5.7876 -24.5700
19 X F 10.6373 -23.1700
20 O1a O 9.4269 -19.6712
21 C1a C 9.4249 -21.0700
22 C5a C 14.2746 -17.9900
23 O5a O 15.4911 -17.2877
24 C1a C 13.0622 -18.9700
25 C1b C 13.0662 -17.2923
26 O1a O 11.8727 -17.9816
27 O2x O 15.4870 -18.9700
28 O2x O 16.8870 -20.3700
29 C1z C 16.8870 -18.9700
30 C1a C 16.8870 -17.5700
31 C1a C 18.2870 -18.9700
BOND 35
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 5 10 1
12 9 11 1
13 11 12 1
14 12 13 1
15 13 14 1
16 10 14 1
17 11 15 1
18 15 16 1
19 16 17 1
20 12 17 1
21 2 18 2
22 10 19 1 #Down
23 14 20 1 #Up
24 5 21 1 #Up
25 17 22 1 #Up
26 22 23 2
27 12 24 1 #Up
28 22 25 1
29 25 26 1
30 17 27 1 #Down
31 16 28 1 #Down
32 28 29 1
33 27 29 1
34 29 30 1
35 29 31 1
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