LJ5FD4
-OEChem-05022321292D
30 30 0 1 0 0 0 0 0999 V2000
4.2690 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 1.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 2.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.0000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.0000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
5.1350 -0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.4030 -0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
3.4030 0.5000 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0
5.1350 0.5000 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0
2.5369 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8059 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6720 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 1.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9264 1.1077 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3249 0.4174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4231 -1.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2700 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0431 -0.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 11 1 0 0 0 0
1 12 1 0 0 0 0
8 2 1 1 0 0 0
2 24 1 0 0 0 0
10 3 1 6 0 0 0
3 25 1 0 0 0 0
12 4 1 6 0 0 0
4 26 1 0 0 0 0
5 13 1 0 0 0 0
5 27 1 0 0 0 0
6 14 2 0 0 0 0
9 7 1 1 0 0 0
7 14 1 0 0 0 0
7 23 1 0 0 0 0
8 9 1 0 0 0 0
8 10 1 0 0 0 0
8 16 1 0 0 0 0
9 12 1 0 0 0 0
9 17 1 0 0 0 0
10 11 1 0 0 0 0
10 18 1 0 0 0 0
11 13 1 1 0 0 0
11 19 1 0 0 0 0
12 20 1 0 0 0 0
13 21 1 0 0 0 0
13 22 1 0 0 0 0
14 15 1 0 0 0 0
15 28 1 0 0 0 0
15 29 1 0 0 0 0
15 30 1 0 0 0 0
M END
$$$$