BP32JS
-OEChem-04012114332D
29 30 0 0 0 0 0 0 0999 V2000
6.3301 -1.8844 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
6.3776 1.2088 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.8844 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 0.1156 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8255 3.2792 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0413 1.8475 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.5468 2.8180 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 1.1156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -0.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.6156 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -2.8844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5686 2.6101 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -3.3844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0468 1.9520 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0611 1.4256 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.0744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.5044 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0781 -3.4670 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4766 -2.7768 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7990 3.3844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -2.8475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -3.6944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -3.9214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -0.1944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 15 1 0 0 0 0
2 13 1 0 0 0 0
2 19 1 0 0 0 0
3 10 1 0 0 0 0
3 16 1 0 0 0 0
4 9 1 0 0 0 0
4 29 1 0 0 0 0
5 17 2 0 0 0 0
6 19 2 0 0 0 0
7 17 1 0 0 0 0
7 19 1 0 0 0 0
7 25 1 0 0 0 0
8 9 2 0 0 0 0
8 11 1 0 0 0 0
8 12 1 0 0 0 0
9 10 1 0 0 0 0
10 14 2 0 0 0 0
11 13 2 0 0 0 0
11 20 1 0 0 0 0
12 15 2 0 0 0 0
12 21 1 0 0 0 0
13 17 1 0 0 0 0
14 15 1 0 0 0 0
14 22 1 0 0 0 0
16 18 1 0 0 0 0
16 23 1 0 0 0 0
16 24 1 0 0 0 0
18 26 1 0 0 0 0
18 27 1 0 0 0 0
18 28 1 0 0 0 0
M END
$$$$