BKL09N
-OEChem-04012116262D
31 33 0 1 0 0 0 0 0999 V2000
9.6814 -0.4488 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.3987 -1.6127 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5274 0.9927 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.0274 -0.5462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3364 0.4049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0274 -0.5462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0547 -0.1316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7183 0.4049 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0321 0.0801 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
6.3518 0.6371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7123 -1.3309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7328 -1.1222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3424 -1.3309 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7029 0.6371 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3374 1.0324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7040 -0.6604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3219 -1.1222 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -0.1316 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6380 0.2114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5365 1.2290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5274 1.6127 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5139 -1.9183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1459 -1.5845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5408 -1.9183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5182 1.2290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9278 0.8431 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5267 1.6228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7470 1.2217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9088 -1.5845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3940 -0.0003 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0980 -0.9079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 16 1 0 0 0 0
1 31 1 0 0 0 0
2 16 2 0 0 0 0
3 5 1 0 0 0 0
3 8 1 0 0 0 0
3 21 1 0 0 0 0
4 5 2 0 0 0 0
4 6 1 0 0 0 0
4 11 1 0 0 0 0
5 10 1 0 0 0 0
6 8 1 0 0 0 0
6 13 2 0 0 0 0
7 9 1 0 0 0 0
7 10 2 0 0 0 0
7 12 1 0 0 0 0
8 14 2 0 0 0 0
9 15 1 0 0 0 0
9 16 1 0 0 0 0
9 19 1 0 0 0 0
10 20 1 0 0 0 0
11 12 2 0 0 0 0
11 22 1 0 0 0 0
12 23 1 0 0 0 0
13 17 1 0 0 0 0
13 24 1 0 0 0 0
14 18 1 0 0 0 0
14 25 1 0 0 0 0
15 26 1 0 0 0 0
15 27 1 0 0 0 0
15 28 1 0 0 0 0
17 18 2 0 0 0 0
17 29 1 0 0 0 0
18 30 1 0 0 0 0
M END
$$$$