BXYJ27 -OEChem-04022107003D 36 38 0 0 0 0 0 0 0999 V2000 0.2274 -2.9065 0.8161 Br 0 0 0 0 0 0 0 0 0 0 0 0 1.7384 1.6484 1.4713 S 0 0 0 0 0 0 0 0 0 0 0 0 0.1429 1.6468 -2.4564 S 0 0 0 0 0 0 0 0 0 0 0 0 3.5819 -0.6772 0.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6173 2.3139 2.1216 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0941 2.1722 1.5925 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0529 0.5748 -1.0570 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1349 0.5939 1.0754 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7601 -0.0261 1.9197 N 0 0 0 0 0 0 0 0 0 0 0 0 3.8605 -1.6970 -0.5820 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3658 1.7667 -0.2002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1661 1.3908 -0.7635 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2778 2.2716 -1.1714 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3782 -0.9108 0.9028 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7407 2.2624 -2.4397 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8434 -2.0705 0.4072 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0247 0.8273 -0.1245 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8080 -2.5170 -0.5124 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7797 -3.7240 -1.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1931 0.0491 -0.5322 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2106 0.8935 -0.0875 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3443 -1.3345 -0.4385 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3789 0.3545 0.4511 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5128 -1.8734 0.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5300 -1.0289 0.5448 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8681 -0.3983 2.2725 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2804 2.6265 -0.9698 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2102 2.5871 -3.3575 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7165 -4.6257 -0.7393 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6785 -3.8091 -1.9774 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9146 -3.7048 -2.0278 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0993 1.9722 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5598 -1.9980 -0.7902 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1710 1.0119 0.7973 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6311 -2.9507 0.1714 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4399 -1.4487 0.9637 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 2 5 2 0 0 0 0 2 6 2 0 0 0 0 2 9 1 0 0 0 0 2 11 1 0 0 0 0 3 12 1 0 0 0 0 3 15 1 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 7 17 1 0 0 0 0 7 20 1 0 0 0 0 8 17 2 0 0 0 0 9 14 1 0 0 0 0 9 26 1 0 0 0 0 10 18 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 17 1 0 0 0 0 13 15 2 0 0 0 0 13 27 1 0 0 0 0 14 16 2 0 0 0 0 15 28 1 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 19 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 22 24 2 0 0 0 0 22 33 1 0 0 0 0 23 25 2 0 0 0 0 23 34 1 0 0 0 0 24 25 1 0 0 0 0 24 35 1 0 0 0 0 25 36 1 0 0 0 0 M END $$$$