BX43IL -OEChem-04022105483D 36 38 0 0 0 0 0 0 0999 V2000 -3.1366 -1.0654 -2.7023 Br 0 0 0 0 0 0 0 0 0 0 0 0 0.3985 -1.2968 1.0037 S 0 0 0 0 0 0 0 0 0 0 0 0 0.2873 -2.6687 1.4770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2429 -0.1938 1.9409 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4562 -0.4119 1.2446 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6592 -1.0818 -0.3327 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8203 -0.1492 1.2105 N 0 0 0 0 0 0 0 0 0 0 0 0 1.9582 -1.1093 0.2262 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.1268 -0.2546 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5833 1.3179 -0.1365 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7677 -2.2376 0.0951 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6467 0.2290 -0.8672 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0167 -2.1327 -0.5171 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4561 -0.8994 -0.9983 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0578 -0.7381 0.0046 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6863 1.6539 -1.1505 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6985 2.1315 0.9907 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0893 -0.7094 -0.8725 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0957 2.8035 -1.0371 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9164 3.2809 1.1041 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1761 -0.3333 -0.0642 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0194 3.6169 0.0903 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5827 -0.1329 -0.4546 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4565 -3.2135 0.4555 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5329 -1.6458 -1.1822 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0071 1.1816 -1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6470 -3.0111 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4285 -0.8179 -1.4752 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5874 1.0348 -2.0391 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3951 1.8863 1.7891 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7942 3.0651 -1.8266 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0063 3.9145 1.9816 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5897 4.5118 0.1786 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6645 0.6547 -1.2107 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0027 -1.0546 -0.8704 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2050 0.1600 0.3979 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 3 2 0 0 0 0 2 4 2 0 0 0 0 2 6 1 0 0 0 0 2 8 1 0 0 0 0 5 7 1 0 0 0 0 5 15 1 0 0 0 0 6 15 1 0 0 0 0 6 25 1 0 0 0 0 7 21 2 0 0 0 0 8 9 1 0 0 0 0 8 11 2 0 0 0 0 9 10 1 0 0 0 0 9 12 2 0 0 0 0 10 16 2 0 0 0 0 10 17 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 12 14 1 0 0 0 0 12 26 1 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 14 28 1 0 0 0 0 15 18 2 0 0 0 0 16 19 1 0 0 0 0 16 29 1 0 0 0 0 17 20 2 0 0 0 0 17 30 1 0 0 0 0 18 21 1 0 0 0 0 19 22 2 0 0 0 0 19 31 1 0 0 0 0 20 22 1 0 0 0 0 20 32 1 0 0 0 0 21 23 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 M END $$$$