RDKit 3D 32 33 0 0 0 0 0 0 0 0999 V2000 -2.0377 -1.1022 1.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3105 -1.3201 1.7291 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3655 -0.5940 1.2119 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2302 0.3080 0.2140 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9836 0.5255 -0.3008 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8553 -0.1523 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4922 0.1483 -0.3287 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3436 0.7065 -1.4104 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5871 -0.1751 0.4804 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9440 0.1774 0.0795 C 0 0 2 0 0 0 0 0 0 0 0 0 2.4487 -0.6740 -1.0964 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9177 -0.3153 -1.2695 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5362 -0.0831 0.3882 S 0 0 0 0 0 0 0 0 0 0 0 0 5.1363 1.2308 0.4831 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2305 -1.2836 0.8044 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9530 -0.0419 1.2028 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9000 1.3812 -1.4279 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9542 2.3080 -1.6140 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5868 -2.5814 3.1021 Br 0 0 0 0 0 0 0 0 0 0 0 0 -1.2077 -1.6893 1.5949 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3806 -0.7204 1.5779 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4121 -0.3317 1.4654 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9444 1.2356 -0.2144 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8919 -0.4942 -2.0209 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3466 -1.7407 -0.8579 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0312 0.6313 -1.8059 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4851 -1.1016 -1.7712 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9361 0.7604 1.9441 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8034 -1.0047 1.7019 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9457 1.7401 -1.5679 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2328 2.3014 -2.5977 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7778 1.9511 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 2 3 1 0 3 4 2 0 4 5 1 0 5 6 2 0 6 7 1 0 7 8 2 0 7 9 1 0 9 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 2 0 13 15 2 0 13 16 1 0 5 17 1 0 17 18 1 0 2 19 1 0 6 1 1 0 16 10 1 0 1 20 1 0 3 21 1 0 9 22 1 0 10 23 1 6 11 24 1 0 11 25 1 0 12 26 1 0 12 27 1 0 16 28 1 0 16 29 1 0 17 30 1 0 18 31 1 0 18 32 1 0 M END