BD6LH3
-OEChem-04022110112D
25 27 0 0 0 0 0 0 0999 V2000
7.2746 1.4796 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5427 1.4596 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -0.0649 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.6660 -2.0649 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -0.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5321 -1.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 -0.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8000 -1.5649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4260 -0.0303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4260 -2.0996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3321 -0.5441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -0.0303 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9061 -2.0996 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3321 -1.5858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5441 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.5858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4144 0.9697 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4188 -2.7196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8678 -0.2321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 0.5897 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9132 -2.7196 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8678 -1.8978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -0.2321 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4643 -1.8978 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2674 2.0996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 17 1 0 0 0 0
1 25 1 0 0 0 0
2 17 2 0 0 0 0
3 5 2 0 0 0 0
3 7 1 0 0 0 0
4 6 2 0 0 0 0
4 8 1 0 0 0 0
5 6 1 0 0 0 0
5 9 1 0 0 0 0
6 10 1 0 0 0 0
7 8 1 0 0 0 0
7 12 2 0 0 0 0
8 13 2 0 0 0 0
9 11 2 0 0 0 0
9 17 1 0 0 0 0
10 14 2 0 0 0 0
10 18 1 0 0 0 0
11 14 1 0 0 0 0
11 19 1 0 0 0 0
12 15 1 0 0 0 0
12 20 1 0 0 0 0
13 16 1 0 0 0 0
13 21 1 0 0 0 0
14 22 1 0 0 0 0
15 16 2 0 0 0 0
15 23 1 0 0 0 0
16 24 1 0 0 0 0
M END
$$$$