RDKit 3D 40 41 0 0 0 0 0 0 0 0999 V2000 -3.3525 1.5285 -0.2789 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3882 0.2891 -1.1587 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2778 -0.7249 -0.8708 N 0 0 0 0 0 4 0 0 0 0 0 0 -1.9734 -0.9534 0.5975 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1866 -1.5191 1.3201 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0413 -0.5138 -1.8073 C 0 0 2 0 0 0 0 0 0 0 0 0 0.0083 -1.6205 -1.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8109 -1.4975 -0.5219 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4604 -0.2924 -0.4236 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6579 -0.2538 0.3174 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3664 0.9731 0.4303 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8122 2.1364 -0.1455 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6075 2.0886 -0.8479 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9384 0.8748 -0.9855 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3600 0.8302 -1.6867 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8791 1.8517 -2.1269 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6368 3.8436 0.0115 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.6728 1.0545 1.1873 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1973 -1.5146 0.9518 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6713 1.3084 0.7437 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3672 1.9926 -0.2217 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0512 2.2747 -0.6717 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3267 0.5514 -2.2199 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3332 -0.2457 -1.0118 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6703 -1.6176 -1.1961 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6151 -0.0169 1.0328 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1874 -1.7060 0.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5244 -2.4487 0.8500 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9258 -1.7463 2.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0292 -0.8242 1.3388 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4586 -0.5806 -2.8204 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6707 -1.6178 -2.5724 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4740 -2.6040 -1.6695 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1906 2.9977 -1.2794 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4195 1.6163 0.6167 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5131 1.5355 2.1575 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1229 0.0748 1.3656 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4406 -1.3375 2.0047 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4757 -2.3368 0.9406 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0914 -1.8498 0.4165 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 1 0 3 4 1 0 4 5 1 0 3 6 1 0 6 7 1 0 7 8 1 0 8 9 1 0 9 10 2 0 10 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 12 17 1 0 11 18 1 0 10 19 1 0 15 6 1 0 14 9 1 0 1 20 1 0 1 21 1 0 1 22 1 0 2 23 1 0 2 24 1 0 3 25 1 0 4 26 1 0 4 27 1 0 5 28 1 0 5 29 1 0 5 30 1 0 6 31 1 6 7 32 1 0 7 33 1 0 13 34 1 0 18 35 1 0 18 36 1 0 18 37 1 0 19 38 1 0 19 39 1 0 19 40 1 0 M CHG 1 3 1 M END