B4HPB7
-OEChem-04012115492D
55 58 0 0 0 0 0 0 0999 V2000
5.4641 -3.0357 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.5357 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
9.0084 -1.8404 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
12.1308 -1.5357 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.1798 -1.8447 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -1.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0622 -0.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5920 -1.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -1.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -2.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0084 -0.2309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -2.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.5920 -1.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -0.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 -0.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.1308 -0.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.1798 -0.2267 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.9399 0.0521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.8353 1.0466 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.6444 1.6344 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.9218 1.4534 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
13.5398 2.6289 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
11.8173 2.4479 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
12.6263 3.0357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.1557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3335 -2.5106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1306 -2.5106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2010 -2.4297 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 -2.6557 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2010 0.3584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -1.4987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -2.3457 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -2.5726 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4860 -0.5357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.0843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2460 -0.5357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1962 0.5843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7932 -0.2257 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2181 -0.5357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.0843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9781 -0.5357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9882 0.3630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.2117 -0.5051 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
13.5358 0.2230 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.6324 -1.9001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.2108 1.3822 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.4202 1.0889 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
14.0414 2.9934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2509 2.7001 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
12.5615 3.6523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 12 2 0 0 0 0
2 7 1 0 0 0 0
2 12 1 0 0 0 0
2 20 1 0 0 0 0
3 8 1 0 0 0 0
3 10 1 0 0 0 0
3 33 1 0 0 0 0
4 5 1 0 0 0 0
4 21 1 0 0 0 0
4 50 1 0 0 0 0
5 17 2 0 0 0 0
6 7 1 0 0 0 0
6 15 1 0 0 0 0
6 16 1 0 0 0 0
6 30 1 0 0 0 0
7 31 1 0 0 0 0
7 32 1 0 0 0 0
8 9 2 0 0 0 0
8 13 1 0 0 0 0
9 14 1 0 0 0 0
9 18 1 0 0 0 0
10 14 2 0 0 0 0
10 17 1 0 0 0 0
11 12 1 0 0 0 0
11 13 2 0 0 0 0
11 19 1 0 0 0 0
13 34 1 0 0 0 0
14 35 1 0 0 0 0
15 36 1 0 0 0 0
15 37 1 0 0 0 0
15 38 1 0 0 0 0
16 39 1 0 0 0 0
16 40 1 0 0 0 0
16 41 1 0 0 0 0
17 22 1 0 0 0 0
18 19 2 0 0 0 0
18 42 1 0 0 0 0
19 43 1 0 0 0 0
20 44 1 0 0 0 0
20 45 1 0 0 0 0
20 46 1 0 0 0 0
21 22 2 0 0 0 0
21 23 1 0 0 0 0
22 47 1 0 0 0 0
23 24 1 0 0 0 0
23 48 1 0 0 0 0
23 49 1 0 0 0 0
24 25 2 0 0 0 0
24 26 1 0 0 0 0
25 27 1 0 0 0 0
25 51 1 0 0 0 0
26 28 2 0 0 0 0
26 52 1 0 0 0 0
27 29 2 0 0 0 0
27 53 1 0 0 0 0
28 29 1 0 0 0 0
28 54 1 0 0 0 0
29 55 1 0 0 0 0
M END
$$$$