L6LJU8
-OEChem-05022321372D
29 31 0 1 0 0 0 0 0999 V2000
6.2619 -1.7320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 1.7552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9889 -1.7552 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.2619 -0.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2619 0.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
7.7619 -0.8660 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.2619 0.0000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
6.7619 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7619 0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7619 -0.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 0.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6783 -0.8047 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2619 -0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9519 -0.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8695 1.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1793 1.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3445 1.0781 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6542 1.4766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0719 -1.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -0.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 10 2 0 0 0 0
2 11 2 0 0 0 0
3 12 2 0 0 0 0
4 15 2 0 0 0 0
7 5 1 1 0 0 0
5 11 1 0 0 0 0
5 12 1 0 0 0 0
6 10 1 0 0 0 0
6 15 1 0 0 0 0
6 25 1 0 0 0 0
7 8 1 0 0 0 0
7 10 1 0 0 0 0
7 20 1 0 0 0 0
8 9 1 0 0 0 0
8 21 1 0 0 0 0
8 22 1 0 0 0 0
9 15 1 0 0 0 0
9 23 1 0 0 0 0
9 24 1 0 0 0 0
11 13 1 0 0 0 0
12 14 1 0 0 0 0
13 14 1 0 0 0 0
13 16 2 0 0 0 0
14 17 2 0 0 0 0
16 18 1 0 0 0 0
16 26 1 0 0 0 0
17 19 1 0 0 0 0
17 27 1 0 0 0 0
18 19 2 0 0 0 0
18 28 1 0 0 0 0
19 29 1 0 0 0 0
M END
$$$$