BP32JS
-OEChem-04012115253D
29 30 0 0 0 0 0 0 0999 V2000
2.5477 -3.6859 1.2848 Br 0 0 0 0 0 0 0 0 0 0 0 0
-2.0460 0.3838 1.2609 S 0 0 0 0 0 0 0 0 0 0 0 0
3.4402 1.1507 -0.4965 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8516 1.4588 -1.3980 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8205 -0.3655 -2.0429 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3346 1.2041 2.2866 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3121 0.4553 0.0784 N 0 0 0 0 0 0 0 0 0 0 0 0
0.3069 -0.7453 -0.6270 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2235 0.2929 -0.7938 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5347 0.1447 -0.3411 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0683 -0.6164 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7013 -1.9314 -0.0073 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1116 -0.1562 -0.3732 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9290 -1.0412 0.2788 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0122 -2.0790 0.4457 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0229 1.6871 0.6896 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4889 -0.0513 -0.9096 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3768 3.1396 0.4518 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7647 0.7551 1.3039 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2224 -0.9314 -2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0131 -2.7422 0.1223 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9537 -1.1585 0.6236 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3267 1.6195 1.5349 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9277 1.1185 0.9304 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3009 0.6015 -0.0973 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8374 3.5806 1.3402 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0703 3.2349 -0.3902 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4823 3.7164 0.1939 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6205 2.0547 -1.4177 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
$$$$