BO14AQ -OEChem-04042106213D 42 45 0 1 0 0 0 0 0999 V2000 -4.9224 -2.4992 -1.8053 Cl 0 0 0 0 0 0 0 0 0 0 0 0 5.4505 -0.0742 -1.7788 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7618 -2.5375 0.8194 F 0 0 0 0 0 0 0 0 0 0 0 0 -4.9622 3.2423 -0.0174 F 0 0 0 0 0 0 0 0 0 0 0 0 -5.9579 2.3017 1.6635 F 0 0 0 0 0 0 0 0 0 0 0 0 3.5633 2.6456 0.6812 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6189 -2.4880 0.7815 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0874 1.1941 -1.1107 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6223 3.4908 -1.1791 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4923 -2.8624 0.9725 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3151 -0.7265 -0.0723 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1609 0.9078 -0.0422 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9691 0.5483 0.4640 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3611 0.2755 0.8360 C 0 0 2 0 0 0 0 0 0 0 0 0 4.2643 1.6422 1.4308 C 0 0 1 0 0 0 0 0 0 0 0 0 5.5688 1.1826 0.8398 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5601 -0.0103 -0.4102 C 0 0 2 0 0 0 0 0 0 0 0 0 4.3909 -0.8267 -1.4035 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3697 -0.8357 -0.0111 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0926 2.3623 -0.5676 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0767 -0.3767 -0.2370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5224 -2.0741 0.5914 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0087 -1.1593 0.1412 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2502 -2.3831 0.7368 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5093 -1.3896 0.2474 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7575 -0.6524 -0.0818 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8062 -1.0564 -0.9296 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7048 -0.0186 -0.8827 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7413 2.1776 0.3239 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4480 -0.5546 1.5266 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2105 1.7127 2.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3741 0.9442 1.5247 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8987 1.6349 -0.0867 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8239 -1.0734 -2.3083 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7999 -1.7529 -0.9929 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8692 0.5811 -0.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2348 3.4594 -2.1157 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6466 4.3914 -0.7135 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5111 -3.0732 1.0705 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4063 0.1870 -0.5122 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6609 0.1334 -1.3651 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7037 2.2887 -0.1841 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 18 1 0 0 0 0 3 22 1 0 0 0 0 4 29 1 0 0 0 0 5 29 1 0 0 0 0 6 15 1 0 0 0 0 6 20 1 0 0 0 0 7 25 2 0 0 0 0 8 17 1 0 0 0 0 8 20 2 0 0 0 0 9 20 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 10 22 1 0 0 0 0 10 24 2 0 0 0 0 11 23 1 0 0 0 0 11 25 1 0 0 0 0 11 40 1 0 0 0 0 12 13 1 0 0 0 0 12 28 1 0 0 0 0 12 29 1 0 0 0 0 13 26 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 14 30 1 0 0 0 0 15 16 1 0 0 0 0 15 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 18 34 1 0 0 0 0 18 35 1 0 0 0 0 19 21 1 0 0 0 0 19 22 2 0 0 0 0 21 23 2 0 0 0 0 21 36 1 0 0 0 0 23 24 1 0 0 0 0 24 39 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 28 41 1 0 0 0 0 29 42 1 0 0 0 0 M END $$$$