B2ENM1
-OEChem-04012112492D
22 22 0 0 0 0 0 0 0999 V2000
6.3301 2.5000 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3301 0.5000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 -2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0000 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4641 2.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -0.6900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1951 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0010 -2.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -3.1200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6900 -0.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4631 -1.3100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 -1.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2520 2.5826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8535 1.8923 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
2 6 1 0 0 0 0
2 12 1 0 0 0 0
3 5 1 0 0 0 0
3 11 1 0 0 0 0
4 11 2 0 0 0 0
5 6 1 0 0 0 0
5 7 2 0 0 0 0
6 8 2 0 0 0 0
7 9 1 0 0 0 0
7 14 1 0 0 0 0
8 10 1 0 0 0 0
8 15 1 0 0 0 0
9 10 2 0 0 0 0
9 16 1 0 0 0 0
10 17 1 0 0 0 0
11 13 1 0 0 0 0
12 18 1 0 0 0 0
12 19 1 0 0 0 0
12 20 1 0 0 0 0
13 21 1 0 0 0 0
13 22 1 0 0 0 0
M END
$$$$