ATOM 33
1 C2x C 8.1200 -25.4100
2 C5x C 8.1200 -26.8100
3 C2x C 9.3324 -27.5100
4 C2y C 10.5449 -26.8100
5 C1z C 10.5449 -25.4100
6 C2x C 9.3324 -24.7100
7 C1x C 11.7573 -27.5100
8 C1x C 12.9697 -26.8100
9 C1y C 12.9697 -25.4100
10 C1z C 11.7573 -24.7100
11 C1y C 14.1822 -24.7100
12 C1z C 14.1822 -23.3100
13 C1x C 12.9697 -22.6100
14 C1y C 11.7573 -23.3100
15 C1x C 16.6070 -24.7100
16 C1y C 16.6070 -23.3100
17 C1z C 15.3946 -22.6100
18 O5x O 6.9076 -27.5100
19 O1a O 10.5469 -22.6112
20 C1a C 10.5449 -24.0100
21 C1a C 14.1822 -21.9100
22 C5a C 15.3946 -20.8600
23 O5a O 16.6111 -20.1577
24 C1b C 14.1862 -20.1623
25 O7a O 12.9927 -20.8516
26 C7a C 11.8044 -20.1655
27 C1a C 10.6137 -20.8532
28 O6a O 11.8042 -18.7602
29 O2x O 18.0070 -23.3100
30 N2x N 16.6070 -21.9100
31 C2y C 18.0070 -21.9100
32 C1a C 18.9884 -20.9285
33 X F 11.7573 -26.1100
BOND 37
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 14 19 1 #Up
23 5 20 1 #Up
24 12 21 1 #Up
25 17 22 1 #Up
26 22 23 2
27 22 24 1
28 24 25 1
29 25 26 1
30 26 27 1
31 26 28 2
32 16 29 1 #Down
33 17 30 1 #Down
34 30 31 2
35 31 29 1
36 31 32 1
37 10 33 1 #Down
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