RDKit 3D 36 38 0 0 0 0 0 0 0 0999 V2000 -5.1888 0.7988 1.7828 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0874 -0.1746 2.7696 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0241 -1.0753 2.7464 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0575 -1.0100 1.7316 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1477 -0.0372 0.7202 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2284 0.8671 0.7703 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1885 0.0691 -0.3732 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4606 -0.8449 -0.9840 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7273 -0.1884 -1.9446 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0384 1.0888 -1.8494 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9802 1.3254 -0.8879 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3029 2.3428 -2.7946 S 0 0 0 0 0 0 0 0 0 0 0 0 1.2256 1.5097 -3.3159 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1810 1.3526 -2.1401 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9857 2.2372 -1.8573 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0344 0.1670 -1.4533 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7300 -0.3205 -0.3197 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2004 -1.5056 0.2263 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7793 -2.1210 1.3399 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9077 -1.5648 1.9280 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4491 -0.3950 1.4014 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8673 0.2271 0.2902 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5198 1.3569 -0.1088 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6314 -2.2658 1.8532 Br 0 0 0 0 0 0 0 0 0 0 0 0 -6.0151 1.5062 1.7978 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8317 -0.2307 3.5605 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9521 -1.8254 3.5311 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3387 1.6368 0.0071 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7215 2.1260 -4.0733 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0159 0.5422 -3.7836 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2361 -0.4049 -1.7284 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3155 -1.9696 -0.2063 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3458 -3.0325 1.7435 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3668 -2.0362 2.7923 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3337 0.0439 1.8571 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9848 1.8050 -0.7958 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