RDKit 3D 36 38 0 0 0 0 0 0 0 0999 V2000 4.6347 -0.7654 -2.2488 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5611 0.4634 -2.8934 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6732 1.4338 -2.4331 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8546 1.1812 -1.3220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9200 -0.0538 -0.6522 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8226 -1.0206 -1.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1087 -0.3731 0.5177 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6076 0.3947 1.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9025 -0.4318 2.3116 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0192 -1.6516 1.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7937 -1.6967 0.7034 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2536 -3.0492 2.5124 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.2714 -2.2901 3.1467 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1654 -1.8584 1.9929 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9003 -2.6676 1.4317 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0305 -0.5236 1.6688 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6677 0.1917 0.6345 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6369 -0.3366 -0.2155 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1902 0.4584 -1.2256 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7794 1.7824 -1.3899 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8128 2.3228 -0.5437 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2686 1.5258 0.4598 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3201 2.0306 1.3121 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6509 2.5763 -0.8402 Br 0 0 0 0 0 0 0 0 0 0 0 0 5.3237 -1.5278 -2.6047 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1909 0.6662 -3.7564 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6205 2.3880 -2.9532 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9082 -1.9910 -0.6524 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8176 -3.0318 3.7383 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0495 -1.4519 3.8148 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3185 0.0304 2.1487 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9817 -1.3612 -0.1202 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9454 0.0379 -1.8853 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2184 2.3919 -2.1758 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5058 3.3557 -0.6721 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9653 2.8514 0.9307 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 5 7 1 0 7 8 2 0 8 9 1 0 9 10 2 0 10 11 1 0 10 12 1 0 12 13 1 0 13 14 1 0 14 15 2 0 14 16 1 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 2 0 20 21 1 0 21 22 2 0 22 23 1 0 4 24 1 0 6 1 1 0 11 7 1 0 22 17 1 0 1 25 1 0 2 26 1 0 3 27 1 0 6 28 1 0 13 29 1 0 13 30 1 0 16 31 1 0 18 32 1 0 19 33 1 0 20 34 1 0 21 35 1 0 23 36 1 0 M END