B81SXA -OEChem-04042107333D 48 50 0 1 0 0 0 0 0999 V2000 -2.8676 0.8290 2.4204 Br 0 0 0 0 0 0 0 0 0 0 0 0 -4.6839 -0.2305 -0.9890 P 0 0 0 0 0 0 0 0 0 0 0 0 -4.4742 -2.4608 -0.1010 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.6776 -0.8524 1.3514 F 0 0 0 0 0 0 0 0 0 0 0 0 3.2456 1.6662 1.1224 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2468 -0.6453 -0.9880 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1378 -0.8646 -2.3729 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4229 1.2378 -0.8254 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 -0.2937 -0.0951 C 0 0 2 0 0 0 0 0 0 0 0 0 1.7737 -1.2767 0.8577 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2699 -1.2614 0.7124 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9619 -0.6651 -0.2725 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3581 1.1754 0.3949 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4780 -0.3885 1.4856 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3319 -2.1211 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4872 -1.2345 0.4441 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1999 1.9753 0.0301 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8663 -0.3750 1.3506 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7200 -2.1075 -0.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9711 -1.2546 0.2651 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5622 -0.4494 -1.4969 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6484 -1.2065 0.7959 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9051 -0.7898 -1.6598 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9913 -1.5467 0.6329 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5454 1.7437 -1.1799 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7429 2.9739 0.8902 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6196 -1.3384 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5658 2.5108 -1.5298 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3684 3.7409 0.5402 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0227 3.5093 -0.6698 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0472 -0.4077 -1.0847 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1149 -2.3072 0.6855 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0158 -1.0522 1.9056 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0095 0.2639 2.2052 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2576 -2.8016 -0.7995 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1874 -2.7812 -1.0401 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0151 -0.0197 -2.3306 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1998 -1.3610 1.7709 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3947 -0.6264 -2.6153 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5497 -1.9688 1.4634 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8795 1.0026 -1.8969 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2349 3.1654 1.8403 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6656 -1.6019 -0.7213 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0726 2.3345 -2.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7260 4.5167 1.2108 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8884 4.1060 -0.9419 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8637 -0.1719 -1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3742 -0.4299 -3.2197 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 8 2 0 0 0 0 2 20 1 0 0 0 0 3 20 1 0 0 0 0 4 20 1 0 0 0 0 5 13 2 0 0 0 0 6 47 1 0 0 0 0 7 48 1 0 0 0 0 9 10 1 0 0 0 0 9 12 1 0 0 0 0 9 13 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 10 33 1 0 0 0 0 11 14 2 0 0 0 0 11 15 1 0 0 0 0 12 21 2 0 0 0 0 12 22 1 0 0 0 0 13 17 1 0 0 0 0 14 18 1 0 0 0 0 14 34 1 0 0 0 0 15 19 2 0 0 0 0 15 35 1 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 16 20 1 0 0 0 0 17 25 2 0 0 0 0 17 26 1 0 0 0 0 19 36 1 0 0 0 0 21 23 1 0 0 0 0 21 37 1 0 0 0 0 22 24 2 0 0 0 0 22 38 1 0 0 0 0 23 27 2 0 0 0 0 23 39 1 0 0 0 0 24 27 1 0 0 0 0 24 40 1 0 0 0 0 25 28 1 0 0 0 0 25 41 1 0 0 0 0 26 29 2 0 0 0 0 26 42 1 0 0 0 0 27 43 1 0 0 0 0 28 30 2 0 0 0 0 28 44 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 30 46 1 0 0 0 0 M END $$$$