BH4K0Z -OEChem-04012112462D 40 42 0 0 0 0 0 0 0999 V2000 9.4372 0.7474 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 6.3582 1.5087 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7891 1.8177 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.6672 2.4598 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0491 0.5576 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9478 2.8633 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.2701 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.3092 1.1997 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8614 3.2701 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4071 1.8177 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0981 2.7688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2299 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0524 1.8688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0981 2.7688 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0305 1.6609 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5305 2.5269 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.2701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.7701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.2701 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5250 2.6314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4381 0.5932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4625 3.2704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7336 3.2704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 0.0399 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -1.4601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -1.4601 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.8901 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.0801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.7331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.5801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -3.8070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5898 2.0148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1416 2.6963 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4602 3.2481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 4 2 0 0 0 0 2 5 2 0 0 0 0 2 8 1 0 0 0 0 2 11 1 0 0 0 0 3 12 1 0 0 0 0 3 17 1 0 0 0 0 6 10 1 0 0 0 0 6 15 1 0 0 0 0 7 14 2 0 0 0 0 8 15 1 0 0 0 0 8 27 1 0 0 0 0 9 14 1 0 0 0 0 9 16 1 0 0 0 0 9 30 1 0 0 0 0 10 22 2 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 14 1 0 0 0 0 13 17 2 0 0 0 0 13 28 1 0 0 0 0 15 18 2 0 0 0 0 16 19 1 0 0 0 0 16 21 2 0 0 0 0 17 29 1 0 0 0 0 18 22 1 0 0 0 0 19 20 2 0 0 0 0 19 31 1 0 0 0 0 20 23 1 0 0 0 0 20 25 1 0 0 0 0 21 24 1 0 0 0 0 21 32 1 0 0 0 0 22 26 1 0 0 0 0 23 24 2 0 0 0 0 23 33 1 0 0 0 0 24 34 1 0 0 0 0 25 35 1 0 0 0 0 25 36 1 0 0 0 0 25 37 1 0 0 0 0 26 38 1 0 0 0 0 26 39 1 0 0 0 0 26 40 1 0 0 0 0 M END $$$$