RDKit 3D 39 39 0 0 0 0 0 0 0 0999 V2000 4.6154 -1.0851 1.3799 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1295 -0.7596 1.3718 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7154 -0.0721 0.0677 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2361 0.3471 0.0526 C 0 0 1 0 0 0 0 0 0 0 0 0 0.9019 1.2577 -1.1439 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2012 0.6661 -2.5161 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3739 -0.8463 -0.0066 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.6436 -1.2291 1.2826 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0446 -0.8437 2.4968 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0769 -2.5917 1.0756 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0302 -0.1638 1.0721 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4581 0.5848 2.1789 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5437 1.4320 2.0382 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1565 1.5022 0.8036 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7500 0.7914 -0.2764 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6854 -0.0418 -0.1542 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3099 -0.7886 -1.2759 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.0373 -0.5048 -2.5014 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1642 2.4580 3.4900 Br 0 0 0 0 0 0 0 0 0 0 0 0 4.8902 -1.5772 2.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2171 -0.1756 1.2847 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8742 -1.7568 0.5551 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9012 -0.1103 2.2246 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5661 -1.6894 1.5052 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9299 -0.7491 -0.7685 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3396 0.8194 -0.0729 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 0.9290 0.9561 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1604 1.5276 -1.1071 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4616 2.1960 -1.0432 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8749 1.3594 -3.2984 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6778 -0.2816 -2.6717 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2731 0.4972 -2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7006 -1.6739 -0.5076 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9521 0.4962 3.1373 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0156 2.1435 0.6286 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -0.7326 -1.4082 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1063 -0.7181 -2.3943 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8964 0.5337 -2.8205 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6547 -1.1503 -3.2986 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 4 7 1 0 7 8 1 0 8 9 2 0 8 10 2 0 8 11 1 0 11 12 2 0 12 13 1 0 13 14 2 0 14 15 1 0 15 16 2 0 16 17 1 0 17 18 1 0 13 19 1 0 16 11 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 3 26 1 0 4 27 1 1 5 28 1 0 5 29 1 0 6 30 1 0 6 31 1 0 6 32 1 0 7 33 1 0 12 34 1 0 14 35 1 0 17 36 1 0 18 37 1 0 18 38 1 0 18 39 1 0 M END