RDKit 3D 36 38 0 0 0 0 0 0 0 0999 V2000 5.1123 1.0327 -0.5786 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9499 2.3586 -0.1955 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6781 2.9281 -0.1995 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5612 2.1746 -0.5921 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7067 0.8341 -0.9920 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0027 0.2795 -0.9721 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5895 0.0046 -1.4325 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4486 0.3214 -2.0105 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2375 -0.8578 -2.2015 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -1.8183 -1.7204 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7131 -1.3493 -1.2371 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0723 -3.4916 -1.6750 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.7262 -3.3260 -1.4801 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0615 -2.8046 -0.0911 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1309 -3.5725 0.8663 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2432 -1.4373 -0.0498 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5203 -0.6279 1.0708 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7432 -1.1065 2.3601 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9912 -0.2110 3.4059 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0189 1.1649 3.1687 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8002 1.6552 1.8832 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5575 0.7572 0.8474 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3504 1.2095 -0.4299 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8805 3.0652 -0.4951 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 0.5817 -0.5724 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8104 2.9492 0.1112 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5656 3.9646 0.1126 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1637 -0.7546 -1.2738 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1542 -2.6872 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1863 -4.3132 -1.5909 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0760 -0.8919 -0.8978 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7335 -2.1686 2.5833 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1665 -0.5928 4.4087 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2215 1.8518 3.9862 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8373 2.7249 1.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1243 2.1536 -0.3922 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