B5HGW3
-OEChem-04012118192D
41 44 0 1 0 0 0 0 0999 V2000
4.0000 2.0005 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.4636 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0
5.5000 1.1345 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0000 0.2685 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0
5.0000 -1.4636 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
10.4851 -0.5363 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
11.0687 0.2685 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.0000 0.2685 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
6.5000 -0.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5000 -0.5976 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.5000 1.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0000 0.2685 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
8.5878 -0.5405 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5878 1.0775 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5388 -0.2315 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
9.5388 0.7685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0000 0.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4851 1.0732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5000 1.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5000 -0.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 -0.5976 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5000 1.1345 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.2685 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3100 0.8054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3923 -1.2081 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0826 -0.8096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8100 -1.1345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0826 1.3466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3923 1.7451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6900 0.8054 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0508 -0.8505 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8400 -1.1070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8400 1.6439 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0508 1.3875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3100 -2.0005 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3800 -1.4636 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.6777 -1.1256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.6777 1.6625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8100 -1.1345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1900 1.6714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3800 0.2685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 19 1 0 0 0 0
2 21 1 0 0 0 0
3 11 1 0 0 0 0
3 12 1 0 0 0 0
8 4 1 6 0 0 0
4 13 1 0 0 0 0
4 14 1 0 0 0 0
10 5 1 6 0 0 0
5 35 1 0 0 0 0
5 36 1 0 0 0 0
6 7 1 0 0 0 0
6 15 1 0 0 0 0
6 37 1 0 0 0 0
7 18 2 0 0 0 0
8 9 1 0 0 0 0
8 11 1 0 0 0 0
8 24 1 0 0 0 0
9 10 1 0 0 0 0
9 25 1 0 0 0 0
9 26 1 0 0 0 0
10 12 1 0 0 0 0
10 27 1 0 0 0 0
11 28 1 0 0 0 0
11 29 1 0 0 0 0
12 17 1 1 0 0 0
12 30 1 0 0 0 0
13 15 1 0 0 0 0
13 31 1 0 0 0 0
13 32 1 0 0 0 0
14 16 1 0 0 0 0
14 33 1 0 0 0 0
14 34 1 0 0 0 0
15 16 2 0 0 0 0
16 18 1 0 0 0 0
17 19 2 0 0 0 0
17 20 1 0 0 0 0
18 38 1 0 0 0 0
19 22 1 0 0 0 0
20 21 2 0 0 0 0
20 39 1 0 0 0 0
21 23 1 0 0 0 0
22 23 2 0 0 0 0
22 40 1 0 0 0 0
23 41 1 0 0 0 0
M END
$$$$