B1PW7U -OEChem-04022102012D 38 41 0 0 0 0 0 0 0999 V2000 8.7516 -3.1008 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 8.1757 -0.5781 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.9910 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.0393 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 2.0151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 1.0151 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 2.0151 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 -0.4849 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6454 -2.4406 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7281 -3.6430 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1454 -3.3066 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 2.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 1.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6641 3.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 2.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 0.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 1.9805 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 4.0151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3961 3.5151 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7702 4.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2622 -0.9849 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3667 -1.9794 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 2.4943 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8641 3.5359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6236 -2.6485 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3448 -2.1873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8448 -1.3213 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8145 -4.0498 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9196 1.1228 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3181 0.4325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 1.3605 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5301 4.6351 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9331 3.8251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7773 4.6697 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8592 -0.7949 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4615 -1.2565 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3932 -1.8742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6856 -4.6562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 2 21 1 0 0 0 0 2 27 1 0 0 0 0 3 23 1 0 0 0 0 4 24 1 0 0 0 0 5 15 2 0 0 0 0 6 16 2 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 15 1 0 0 0 0 8 16 1 0 0 0 0 8 21 1 0 0 0 0 8 35 1 0 0 0 0 9 11 1 0 0 0 0 9 25 1 0 0 0 0 9 37 1 0 0 0 0 10 25 2 0 0 0 0 10 28 1 0 0 0 0 11 28 2 0 0 0 0 12 14 1 0 0 0 0 12 17 2 0 0 0 0 13 16 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 18 1 0 0 0 0 14 20 2 0 0 0 0 15 19 1 0 0 0 0 17 23 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 32 1 0 0 0 0 19 33 1 0 0 0 0 20 24 1 0 0 0 0 20 34 1 0 0 0 0 21 22 2 0 0 0 0 22 25 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 26 27 2 0 0 0 0 27 36 1 0 0 0 0 28 38 1 0 0 0 0 M END $$$$