ATOM 29
1 C2x C 26.4600 -16.5200
2 C5x C 26.4600 -17.9200
3 C2x C 27.6500 -18.6200
4 C2y C 28.8400 -17.9200
5 C1z C 28.8400 -16.5200
6 C2x C 27.6500 -15.8900
7 C1y C 30.0300 -18.6200
8 C1x C 31.2200 -17.9200
9 C1y C 31.2200 -16.5200
10 C1z C 30.0300 -15.8900
11 C1y C 32.4800 -15.8900
12 C1z C 32.4800 -14.4900
13 C1x C 31.2200 -13.7900
14 C1y C 30.0300 -14.4900
15 C1x C 33.7400 -16.3100
16 C1y C 34.5800 -15.1900
17 C1z C 33.7400 -14.0700
18 O5x O 25.2700 -18.6200
19 C1a C 28.8400 -15.1900
20 O1a O 28.8400 -13.7900
21 C1a C 32.4800 -13.0900
22 C5a C 33.7400 -11.9700
23 X F 30.0300 -17.2200
24 X F 30.0300 -20.0200
25 O5a O 35.0000 -11.2700
26 C1b C 32.6200 -11.2700
27 O1a O 31.4300 -11.9700
28 O1a O 35.0923 -13.7077
29 O1a O 35.9800 -15.1900
BOND 32
1 1 2 1
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 1
6 1 6 2
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 5 19 1 #Up
23 14 20 1 #Up
24 12 21 1 #Up
25 17 22 1 #Up
26 10 23 1 #Down
27 7 24 1 #Down
28 22 25 2
29 22 26 1
30 26 27 1
31 17 28 1 #Down
32 16 29 1 #Down
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