BHV06S
-OEChem-04012113352D
28 29 0 0 0 0 0 0 0999 V2000
6.8671 -3.1012 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0
8.4497 2.2352 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 -0.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5369 -1.6012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -0.1012 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -0.1012 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 1.3988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -1.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2690 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8671 1.8988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 0.3988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -2.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9716 2.8933 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4030 -1.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7806 1.4921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9497 3.1012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.2088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5380 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.7088 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1350 -3.7212 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5108 3.3082 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9095 0.8856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2019 3.6676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.2912 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 14 1 0 0 0 0
2 18 1 0 0 0 0
2 19 1 0 0 0 0
3 13 2 0 0 0 0
4 17 1 0 0 0 0
4 28 1 0 0 0 0
5 17 2 0 0 0 0
6 8 1 0 0 0 0
6 13 1 0 0 0 0
6 20 1 0 0 0 0
7 12 1 0 0 0 0
7 13 1 0 0 0 0
7 23 1 0 0 0 0
8 9 2 0 0 0 0
8 10 1 0 0 0 0
9 11 1 0 0 0 0
9 17 1 0 0 0 0
10 14 2 0 0 0 0
10 21 1 0 0 0 0
11 15 2 0 0 0 0
11 22 1 0 0 0 0
12 16 1 0 0 0 0
12 18 2 0 0 0 0
14 15 1 0 0 0 0
15 24 1 0 0 0 0
16 19 2 0 0 0 0
16 25 1 0 0 0 0
18 26 1 0 0 0 0
19 27 1 0 0 0 0
M END
$$$$