B6ORM5
-OEChem-04012116412D
61 65 0 0 0 0 0 0 0999 V2000
7.1377 -0.5570 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6079 2.1740 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6079 3.8505 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.7705 2.5516 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
10.7866 0.4599 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.3979 -2.5503 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.2435 0.9708 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.1256 2.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2596 2.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0356 2.0054 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3935 2.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0436 0.9638 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3935 3.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1415 0.4430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.1256 3.5123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2659 -2.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2596 4.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4996 1.9776 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2697 -1.0536 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9624 2.5695 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4996 4.0469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5935 2.4915 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5935 3.5331 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9790 0.4141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3941 -3.5503 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5338 -2.0470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9103 2.0416 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.9187 0.9566 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 3.0123 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5261 -4.0469 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6659 -2.5436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7589 3.5515 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7905 -0.5400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4757 -2.6370 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8769 -1.9483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6625 3.8223 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2596 4.6323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5068 1.3577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0599 -0.4702 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6587 -1.1589 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9505 3.1894 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5068 4.6669 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9766 -0.2059 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6039 -4.1337 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0051 -3.4450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9342 -1.5735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1371 -1.5705 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5391 3.4270 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5391 2.5976 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2182 -3.5088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9880 -4.3549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8341 -4.5851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3580 -2.0055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1278 -2.8515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9738 -3.0817 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.3789 3.5586 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7518 4.1714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1390 3.5443 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1705 -0.5424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7929 -1.1600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
11.4105 -0.5377 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 1 0 0 0 0
1 19 1 0 0 0 0
2 22 1 0 0 0 0
2 29 1 0 0 0 0
3 23 1 0 0 0 0
3 29 1 0 0 0 0
4 27 1 0 0 0 0
4 32 1 0 0 0 0
5 28 1 0 0 0 0
5 33 1 0 0 0 0
6 16 1 0 0 0 0
6 25 1 0 0 0 0
6 26 1 0 0 0 0
7 9 1 0 0 0 0
7 14 2 0 0 0 0
8 9 2 0 0 0 0
8 10 1 0 0 0 0
8 15 1 0 0 0 0
9 11 1 0 0 0 0
10 12 1 0 0 0 0
10 20 2 0 0 0 0
11 13 1 0 0 0 0
11 18 2 0 0 0 0
12 14 1 0 0 0 0
12 24 2 0 0 0 0
13 17 1 0 0 0 0
13 21 2 0 0 0 0
15 17 2 0 0 0 0
15 36 1 0 0 0 0
16 19 1 0 0 0 0
16 34 1 0 0 0 0
16 35 1 0 0 0 0
17 37 1 0 0 0 0
18 22 1 0 0 0 0
18 38 1 0 0 0 0
19 39 1 0 0 0 0
19 40 1 0 0 0 0
20 27 1 0 0 0 0
20 41 1 0 0 0 0
21 23 1 0 0 0 0
21 42 1 0 0 0 0
22 23 2 0 0 0 0
24 28 1 0 0 0 0
24 43 1 0 0 0 0
25 30 1 0 0 0 0
25 44 1 0 0 0 0
25 45 1 0 0 0 0
26 31 1 0 0 0 0
26 46 1 0 0 0 0
26 47 1 0 0 0 0
27 28 2 0 0 0 0
29 48 1 0 0 0 0
29 49 1 0 0 0 0
30 50 1 0 0 0 0
30 51 1 0 0 0 0
30 52 1 0 0 0 0
31 53 1 0 0 0 0
31 54 1 0 0 0 0
31 55 1 0 0 0 0
32 56 1 0 0 0 0
32 57 1 0 0 0 0
32 58 1 0 0 0 0
33 59 1 0 0 0 0
33 60 1 0 0 0 0
33 61 1 0 0 0 0
M END
$$$$