ATOM 39
1 C8x C 19.2500 -8.7500
2 C8x C 19.2500 -10.1500
3 C8x C 18.0600 -10.8500
4 C8y C 16.8000 -10.1500
5 C8x C 16.8000 -8.7500
6 C8x C 18.0600 -8.0500
7 C2c C 15.6100 -10.8500
8 C8y C 14.3500 -10.1500
9 N5x N 13.1600 -10.8500
10 C8x C 11.9000 -10.1500
11 C8x C 11.9000 -8.7500
12 C8x C 13.1600 -8.0500
13 C8x C 14.3500 -8.7500
14 C2y C 15.6100 -12.2500
15 C5x C 18.2700 -14.7700
16 N1x N 18.2700 -16.1700
17 C5x C 16.9400 -16.5900
18 C1y C 16.1000 -15.4700
19 C1y C 16.9400 -14.3500
20 C1y C 15.8200 -13.4400
21 C1y C 14.9100 -14.7700
22 C2y C 13.5800 -15.1200
23 C2x C 13.5800 -14.0000
24 O5x O 19.3900 -13.9300
25 O5x O 16.5200 -17.9200
26 C1d C 12.7400 -16.2400
27 O1a O 13.7200 -17.2200
28 C8y C 11.6900 -15.2600
29 C8y C 12.0400 -17.4300
30 C8x C 10.5000 -15.9600
31 C8x C 9.2400 -15.2600
32 C8x C 9.2400 -13.8600
33 C8x C 10.5000 -13.0900
34 C8x C 11.6900 -13.7900
35 C8x C 12.7400 -18.6200
36 C8x C 12.0400 -19.8800
37 C8x C 10.6400 -19.8800
38 C8x C 9.9400 -18.6200
39 N5x N 10.6400 -17.4300
BOND 45
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 8 13 1
15 7 14 2
16 15 16 1
17 16 17 1
18 17 18 1
19 18 19 1
20 15 19 1
21 19 20 1
22 18 21 1
23 21 22 1
24 20 23 1
25 23 22 2
26 14 20 1
27 21 14 1
28 15 24 2
29 17 25 2
30 22 26 1
31 26 27 1
32 26 28 1
33 26 29 1
34 28 30 2
35 30 31 1
36 31 32 2
37 32 33 1
38 33 34 2
39 28 34 1
40 29 35 2
41 35 36 1
42 36 37 2
43 37 38 1
44 38 39 2
45 29 39 1
|