RDKit 3D 37 42 0 0 0 0 0 0 0 0999 V2000 3.3892 3.1254 0.8703 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9192 2.0037 0.6114 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6996 1.0190 1.6705 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1985 -0.1221 1.3317 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8691 -1.6774 2.2074 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0321 -2.7996 0.7523 C 0 0 2 0 0 0 0 0 0 0 0 0 2.5448 -1.8050 -0.3027 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8012 -0.5308 -0.0598 C 0 0 2 0 0 0 0 0 0 0 0 0 2.0842 0.4837 -1.0672 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5902 1.6860 -0.7673 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9229 2.9474 -2.1336 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.3377 -0.8301 -0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1891 -2.0291 0.1355 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6981 -3.1599 0.2802 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6399 -2.2856 0.1612 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1126 -3.4275 0.2883 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5947 -1.1727 0.0343 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9231 -0.9891 0.0114 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.2255 0.3379 -0.1367 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9995 1.0071 -0.2089 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0168 0.0667 -0.1026 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5855 0.3104 -0.1288 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2425 1.5307 -0.2654 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1335 2.6415 -0.3908 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5794 2.4084 -0.3639 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9353 1.2053 2.7025 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7061 -3.6183 0.9171 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6393 -1.6781 -0.1438 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2923 -2.2056 -1.2862 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8804 0.2612 -2.0885 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3811 -4.0991 0.0631 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6097 -1.7371 0.0933 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2052 0.7875 -0.1885 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8676 3.1609 -1.3576 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8434 3.3919 0.3991 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0929 2.8056 -1.2846 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0604 2.9869 0.4784 H 0 0 0 0 0 0 0 0 0 0 0 0 11 10 1 0 10 9 2 0 8 9 1 6 8 7 1 0 7 6 1 0 6 14 1 0 14 13 1 0 13 12 2 0 12 22 1 0 22 23 2 0 23 24 1 0 24 25 1 0 25 20 1 0 20 19 2 0 19 18 1 0 18 17 1 0 17 21 2 0 17 15 1 0 15 16 2 0 6 5 1 0 5 4 1 0 4 3 2 0 3 2 1 0 2 1 2 0 2 10 1 0 12 8 1 0 21 22 1 0 4 8 1 0 15 13 1 0 21 20 1 0 9 30 1 0 7 28 1 0 7 29 1 0 6 27 1 1 14 31 1 0 24 34 1 0 24 35 1 0 25 36 1 0 25 37 1 0 19 33 1 0 18 32 1 0 3 26 1 0 M END