ATOM 29
1 X F 17.7100 -25.4800
2 C1d C 18.9000 -26.1800
3 C1d C 20.0900 -25.4800
4 C1d C 21.2800 -26.1800
5 C1d C 22.5400 -25.4800
6 C1d C 23.7300 -26.1800
7 C1d C 24.9200 -25.4800
8 C1d C 26.1100 -26.1800
9 C1d C 27.3000 -25.4800
10 S4a S 28.4900 -26.1800
11 X F 19.3900 -24.2900
12 X F 20.7900 -24.2900
13 X F 20.5800 -27.4400
14 X F 21.9800 -27.4400
15 X F 21.7700 -24.2900
16 X F 23.2400 -24.2900
17 X F 23.0300 -27.3700
18 X F 24.4300 -27.3700
19 X F 25.4100 -27.3700
20 X F 26.8100 -27.3700
21 X F 24.2200 -24.2900
22 X F 25.6200 -24.2900
23 X F 26.6000 -24.2900
24 X F 28.0000 -24.2900
25 X F 18.9000 -27.5800
26 X F 17.7100 -26.8800
27 O3c O 29.6800 -25.4800
28 O3c O 28.4900 -27.5800
29 X F 29.6800 -26.8800
BOND 28
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 3 11 1
11 3 12 1
12 4 13 1
13 4 14 1
14 5 15 1
15 5 16 1
16 6 17 1
17 6 18 1
18 8 19 1
19 8 20 1
20 7 21 1
21 7 22 1
22 9 23 1
23 9 24 1
24 2 25 1
25 2 26 1
26 10 27 2
27 10 28 2
28 10 29 1
|