BJ7QB3
-OEChem-04012112102D
35 35 0 1 0 0 0 0 0999 V2000
7.7331 -1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 0.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -2.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -1.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 0.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 2.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.0950 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.8671 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -0.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3905 1.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7890 0.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9451 0.3224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3437 1.0127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7890 2.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3905 1.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3437 1.7973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9451 2.4876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2656 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4685 2.8800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5380 -1.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5335 -0.1201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7365 -0.1201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8705 -1.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6675 -1.5700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5380 -2.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8015 -0.1201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0044 -0.1201 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.7850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -1.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 11 2 0 0 0 0
2 5 1 0 0 0 0
2 6 1 0 0 0 0
2 11 1 0 0 0 0
3 10 1 0 0 0 0
3 30 1 0 0 0 0
3 31 1 0 0 0 0
4 14 1 0 0 0 0
4 34 1 0 0 0 0
4 35 1 0 0 0 0
5 7 1 0 0 0 0
5 15 1 0 0 0 0
5 16 1 0 0 0 0
6 8 1 0 0 0 0
6 17 1 0 0 0 0
6 18 1 0 0 0 0
7 9 1 0 0 0 0
7 19 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 23 1 0 0 0 0
9 24 1 0 0 0 0
10 11 1 0 0 0 0
10 12 1 0 0 0 0
10 25 1 0 0 0 0
12 13 1 0 0 0 0
12 26 1 0 0 0 0
12 27 1 0 0 0 0
13 14 1 0 0 0 0
13 28 1 0 0 0 0
13 29 1 0 0 0 0
14 32 1 0 0 0 0
14 33 1 0 0 0 0
M END
$$$$