RDKit 3D 56 59 0 0 0 0 0 0 0 0999 V2000 -3.3120 -1.7346 -2.5682 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4196 -0.7507 -2.3254 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7134 -1.0475 -2.7781 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7691 -0.1579 -2.5614 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5506 1.0423 -1.8900 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2762 1.3495 -1.4169 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2239 0.4459 -1.6143 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8986 0.8101 -1.0744 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0894 1.3452 -1.8215 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6497 0.5217 0.2551 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.6289 0.0329 1.2150 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8247 -0.2010 2.4828 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7618 0.8897 2.4238 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4787 1.0693 0.9273 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1679 0.4752 0.5013 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9400 1.1925 0.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9508 0.3862 -0.0380 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4607 -0.8193 -0.1749 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1362 -0.8334 0.1791 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7076 -1.9985 0.2115 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3490 -2.2021 -0.7114 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6557 -1.4060 -1.6917 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8806 -1.1164 -0.8382 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8797 -1.8272 -0.9254 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7333 -0.0043 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6741 0.5625 0.8523 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2511 1.6627 1.6087 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1266 2.3001 2.4959 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4318 1.8340 2.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8637 0.7342 1.8861 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9859 0.1043 0.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6232 2.6939 3.8192 Br 0 0 0 0 0 0 0 0 0 0 0 0 -3.2197 -2.4053 -1.7118 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3548 -1.2350 -2.7431 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5145 -2.3412 -3.4583 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9089 -1.9773 -3.3129 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7642 -0.4016 -2.9301 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3707 1.7406 -1.7404 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1008 2.2927 -0.9067 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3810 0.8153 1.3668 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1202 -0.8729 0.8461 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4398 -0.1444 3.3858 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 -1.1881 2.4617 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1892 1.8169 2.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8784 0.6496 3.0224 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4403 2.1419 0.7006 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7538 -1.7291 0.1117 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4637 -2.6591 -0.6248 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5466 -2.5155 1.1623 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9540 -2.0986 -2.4869 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3071 -0.4936 -2.1827 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8093 0.4296 -0.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2336 2.0392 1.5167 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7798 3.1534 3.0745 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8799 0.3632 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3623 -0.7341 0.4205 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 2 3 2 0 3 4 1 0 4 5 2 0 5 6 1 0 6 7 2 0 7 8 1 0 8 9 2 0 8 10 1 0 10 11 1 0 11 12 1 0 12 13 1 0 13 14 1 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 2 0 18 19 1 0 19 20 1 0 18 21 1 0 21 22 1 0 22 23 1 0 23 24 2 0 23 25 1 0 25 26 1 0 26 27 2 0 27 28 1 0 28 29 2 0 29 30 1 0 30 31 2 0 29 32 1 0 7 2 1 0 14 10 1 0 19 15 1 0 31 26 1 0 1 33 1 0 1 34 1 0 1 35 1 0 3 36 1 0 4 37 1 0 5 38 1 0 6 39 1 0 11 40 1 0 11 41 1 0 12 42 1 0 12 43 1 0 13 44 1 0 13 45 1 0 14 46 1 1 20 47 1 0 20 48 1 0 20 49 1 0 22 50 1 0 22 51 1 0 25 52 1 0 27 53 1 0 28 54 1 0 30 55 1 0 31 56 1 0 M END