RDKit 3D 35 35 0 0 0 0 0 0 0 0999 V2000 -5.5604 -2.3120 -0.8083 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9662 -1.4115 0.6436 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.3202 -0.9411 0.0155 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5373 -0.2151 1.1103 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1944 0.3288 0.6023 C 0 0 2 0 0 0 0 0 0 0 0 0 -0.1498 -0.7937 0.3659 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4227 -1.9903 0.4146 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0978 -0.3415 -0.0006 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1449 -1.2533 -0.3868 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4365 -0.5041 -0.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 0.2863 -1.4421 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1978 0.8393 -1.1023 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6342 0.4717 0.1447 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5050 -0.5552 0.9193 S 0 0 0 0 0 0 0 0 0 0 0 0 6.1435 1.9665 -2.2811 Br 0 0 0 0 0 0 0 0 0 0 0 0 -0.6768 1.3115 1.5633 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1548 2.3129 1.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 2.4880 0.0245 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5497 3.0942 2.2014 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9157 -3.1703 -1.0143 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5870 -1.6531 -1.6801 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5731 -2.6762 -0.6166 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8011 -1.8461 -0.3096 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4553 -0.2862 -0.8514 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3707 -0.8834 1.9656 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1363 0.6281 1.4812 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3451 0.8387 -0.3579 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1925 0.6438 -0.2463 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1718 -2.0990 0.3092 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8986 -1.6474 -1.3792 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4164 0.4557 -2.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5516 0.7504 0.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4957 0.9701 2.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0773 3.9081 1.9086 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1468 3.2856 2.9080 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 5 6 1 0 6 7 2 0 6 8 1 0 8 9 1 0 9 10 1 0 10 11 2 0 11 12 1 0 12 13 2 0 13 14 1 0 12 15 1 0 5 16 1 0 16 17 1 0 17 18 2 0 17 19 1 0 14 10 1 0 1 20 1 0 1 21 1 0 1 22 1 0 3 23 1 0 3 24 1 0 4 25 1 0 4 26 1 0 5 27 1 6 8 28 1 0 9 29 1 0 9 30 1 0 11 31 1 0 13 32 1 0 16 33 1 0 19 34 1 0 19 35 1 0 M END