BQX90F -OEChem-04022100532D 55 57 0 0 0 0 0 0 0999 V2000 8.0622 -4.2306 0.0000 Cl 0 0 0 0 0 0 0 0 0 0 0 0 10.9003 4.2306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2306 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0978 2.1944 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.0868 2.4035 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -0.7306 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6801 1.4899 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3007 0.2640 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4990 3.2125 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0813 2.5080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9058 4.1260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4881 3.4216 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1097 -1.1373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2788 0.4719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6856 1.3854 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7788 -0.3942 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3176 -2.1155 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -3.7306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.2306 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9850 3.5592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0684 2.7665 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0381 1.8895 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6829 2.3580 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9490 4.7445 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3042 4.2760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0021 3.0749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9188 3.8676 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1181 -0.6480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7196 -1.3382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0445 0.9883 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 -3.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 -3.2055 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3954 -0.4590 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7331 -2.4206 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 -2.1936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -3.2675 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -1.2306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6106 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -1.2306 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7112 -2.2444 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4465 -2.7219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9241 -1.9866 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 -4.0406 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -4.8506 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 2 11 1 0 0 0 0 2 12 1 0 0 0 0 3 19 1 0 0 0 0 3 20 1 0 0 0 0 4 18 2 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 5 10 1 0 0 0 0 6 8 1 0 0 0 0 6 13 1 0 0 0 0 6 16 1 0 0 0 0 7 18 1 0 0 0 0 7 39 1 0 0 0 0 8 17 2 0 0 0 0 9 11 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 12 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 20 2 0 0 0 0 14 22 1 0 0 0 0 15 19 1 0 0 0 0 15 23 1 0 0 0 0 15 24 1 0 0 0 0 15 40 1 0 0 0 0 16 21 2 0 0 0 0 16 25 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 19 41 1 0 0 0 0 19 42 1 0 0 0 0 20 26 1 0 0 0 0 21 43 1 0 0 0 0 22 27 2 0 0 0 0 22 44 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 28 2 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 28 55 1 0 0 0 0 M END $$$$