BT5YQ2
-OEChem-04012116132D
36 38 0 1 0 0 0 0 0999 V2000
2.0000 -0.0896 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0
5.8578 2.2836 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
7.6183 2.5594 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0
7.1279 -1.0896 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.3368 0.1998 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.6350 1.7833 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
8.2101 -2.1941 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
9.2305 -0.7946 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8066 0.9730 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.5443 -1.8944 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0
5.8550 0.6656 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6146 0.3838 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0
5.5443 -0.2849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2686 1.4756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -0.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5083 -0.6105 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8083 1.9730 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5981 -1.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1279 -1.0896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5288 0.7890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -0.0896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.0896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3163 -1.1997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -0.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8660 -1.5896 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0477 0.1326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8085 1.8913 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8071 1.0616 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9126 -0.4386 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2355 -1.1673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7369 -2.4837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 0.5304 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7320 -2.7096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3291 -1.8996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9036 0.4510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7110 -2.5594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0
1 24 1 0 0 0 0
2 14 1 0 0 0 0
2 17 1 0 0 0 0
3 17 2 0 0 0 0
4 19 2 0 0 0 0
5 20 1 0 0 0 0
5 35 1 0 0 0 0
6 20 2 0 0 0 0
7 23 1 0 0 0 0
7 36 1 0 0 0 0
8 23 2 0 0 0 0
9 11 1 0 0 0 0
9 12 1 0 0 0 0
9 17 1 0 0 0 0
10 18 1 0 0 0 0
10 19 1 0 0 0 0
10 31 1 0 0 0 0
11 13 2 0 0 0 0
11 14 1 0 0 0 0
12 16 1 0 0 0 0
12 20 1 0 0 0 0
12 26 1 0 0 0 0
13 15 1 0 0 0 0
13 19 1 0 0 0 0
14 27 1 0 0 0 0
14 28 1 0 0 0 0
15 18 2 0 0 0 0
15 21 1 0 0 0 0
16 23 1 0 0 0 0
16 29 1 0 0 0 0
16 30 1 0 0 0 0
18 22 1 0 0 0 0
21 24 2 0 0 0 0
21 32 1 0 0 0 0
22 25 2 0 0 0 0
22 33 1 0 0 0 0
24 25 1 0 0 0 0
25 34 1 0 0 0 0
M END
$$$$