BYB45J -OEChem-04022100452D 61 62 0 1 0 0 0 0 0999 V2000 8.0238 2.4571 0.0000 Br 0 0 0 0 0 0 0 0 0 0 0 0 12.2970 -1.1307 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7279 -0.8216 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.4002 -2.8907 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5702 -2.7862 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 13.2200 0.4571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.1926 -2.4689 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4879 3.4571 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9021 -2.5711 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4374 -0.9238 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4879 0.4571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3540 1.9571 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5963 -2.2110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.6789 -1.1307 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.9879 -2.0817 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.4879 -0.5429 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 11.9879 -2.0817 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 12.5757 -2.8907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6219 0.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3540 0.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9847 -1.4908 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6219 1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0337 -1.1818 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4879 2.4571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2905 -1.8509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3395 -1.5419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7559 2.4571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9511 -2.2621 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8899 1.9571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6453 -1.9020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9531 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6420 -3.2132 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2601 -1.3110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5819 -0.5183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3756 -1.9847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9355 -0.2614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6003 -1.9847 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0185 -3.1625 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7466 -3.4867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6523 -3.4571 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0850 0.6471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3247 -0.6343 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5451 -0.8000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9347 -3.2878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8909 2.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9994 -2.3983 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7791 -2.2326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6305 -0.9944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8509 -1.1602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7559 3.0771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7252 -2.8174 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8899 1.3371 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1916 -1.3634 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4103 -1.7615 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8084 -2.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0524 -3.0216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4504 -3.8028 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2317 -3.4047 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8497 -1.5026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4517 -0.7214 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6704 -1.1194 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 16 1 0 0 0 0 2 17 1 0 0 0 0 14 3 1 6 0 0 0 3 21 1 0 0 0 0 15 4 1 1 0 0 0 4 40 1 0 0 0 0 5 18 1 0 0 0 0 5 44 1 0 0 0 0 6 20 2 0 0 0 0 7 21 2 0 0 0 0 8 24 2 0 0 0 0 9 28 1 0 0 0 0 9 30 1 0 0 0 0 10 30 2 0 0 0 0 16 11 1 6 0 0 0 11 19 1 0 0 0 0 11 20 1 0 0 0 0 12 20 1 0 0 0 0 12 24 1 0 0 0 0 12 45 1 0 0 0 0 13 26 1 0 0 0 0 13 30 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 34 1 0 0 0 0 15 17 1 0 0 0 0 15 35 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 6 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 19 22 2 0 0 0 0 19 41 1 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 27 1 0 0 0 0 23 25 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 25 26 1 0 0 0 0 25 46 1 0 0 0 0 25 47 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 29 2 0 0 0 0 27 50 1 0 0 0 0 28 31 1 0 0 0 0 28 32 1 0 0 0 0 28 33 1 0 0 0 0 29 52 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 32 56 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 59 1 0 0 0 0 33 60 1 0 0 0 0 33 61 1 0 0 0 0 M END $$$$