BMSK67
-OEChem-04012118012D
29 31 0 0 0 0 0 0 0999 V2000
4.5274 1.8484 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
8.0321 0.9359 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
6.3518 1.4929 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.7328 -0.2665 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.3923 -1.4226 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
3.3424 -0.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0274 0.3096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3219 -0.2665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 0.7242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7029 1.4929 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7183 1.2606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0274 0.3096 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3364 1.2606 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7123 -0.4752 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0547 0.7242 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3374 1.8881 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1160 -1.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8724 -0.7969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7081 -0.3543 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3034 -0.8862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6208 1.2147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4518 0.4345 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9426 2.0647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1806 1.8268 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8018 -1.8881 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7844 -1.5445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9278 1.6988 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5267 2.4785 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7470 2.0774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 11 1 0 0 0 0
1 13 1 0 0 0 0
2 15 1 0 0 0 0
2 16 1 0 0 0 0
3 13 2 0 0 0 0
3 15 1 0 0 0 0
4 14 1 0 0 0 0
4 15 2 0 0 0 0
5 14 1 0 0 0 0
5 25 1 0 0 0 0
5 26 1 0 0 0 0
6 7 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 11 2 0 0 0 0
7 12 1 0 0 0 0
8 9 1 0 0 0 0
8 19 1 0 0 0 0
8 20 1 0 0 0 0
9 10 1 0 0 0 0
9 21 1 0 0 0 0
9 22 1 0 0 0 0
10 11 1 0 0 0 0
10 23 1 0 0 0 0
10 24 1 0 0 0 0
12 13 1 0 0 0 0
12 14 2 0 0 0 0
16 27 1 0 0 0 0
16 28 1 0 0 0 0
16 29 1 0 0 0 0
M END
$$$$