B23UKE
-OEChem-04022102303D
29 30 0 0 0 0 0 0 0999 V2000
2.7980 2.4057 1.0156 Br 0 0 0 0 0 0 0 0 0 0 0 0
-0.2986 1.6231 -1.9724 S 0 0 0 0 0 0 0 0 0 0 0 0
-4.3807 -0.8105 0.5068 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.0551 0.9295 1.5389 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9095 0.0619 -0.4764 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.9963 -1.1828 0.2747 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1433 0.5108 -1.1067 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1852 -1.1364 1.2244 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2840 0.4835 -0.0988 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7329 0.7073 -0.6620 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2692 0.5311 0.4280 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5964 -0.0738 0.1579 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7867 0.6224 0.3668 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6293 -1.3834 -0.3210 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0101 0.0091 0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8527 -1.9969 -0.5909 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0432 -1.3006 -0.3819 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0897 -1.4234 0.8308 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1476 -1.9760 -0.4677 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3496 -0.1872 -1.9269 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0558 1.5179 -1.5229 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3314 -2.1143 1.6934 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0316 -0.4001 2.0223 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1430 1.2373 0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2346 0.6932 -0.5989 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7178 -1.9456 -0.4989 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9482 0.5356 0.2534 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8785 -3.0161 -0.9654 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9956 -1.7782 -0.5925 H 0 0 0 0 0 0 0 0 0 0 0 0
1 13 1 0 0 0 0
2 10 2 0 0 0 0
3 8 1 0 0 0 0
3 9 1 0 0 0 0
4 11 2 0 0 0 0
5 6 1 0 0 0 0
5 7 1 0 0 0 0
5 10 1 0 0 0 0
6 8 1 0 0 0 0
6 18 1 0 0 0 0
6 19 1 0 0 0 0
7 9 1 0 0 0 0
7 20 1 0 0 0 0
7 21 1 0 0 0 0
8 22 1 0 0 0 0
8 23 1 0 0 0 0
9 24 1 0 0 0 0
9 25 1 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 13 1 0 0 0 0
12 14 2 0 0 0 0
13 15 2 0 0 0 0
14 16 1 0 0 0 0
14 26 1 0 0 0 0
15 17 1 0 0 0 0
15 27 1 0 0 0 0
16 17 2 0 0 0 0
16 28 1 0 0 0 0
17 29 1 0 0 0 0
M END
$$$$