IBS-ZINC05576523 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 0 0 0 0 0 0999 V2000 0.5410 0.8670 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -0.3560 -0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -0.0240 1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -0.7290 -0.2980 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5860 -1.9980 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7800 -2.8340 0.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0020 -2.3740 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0140 -1.6390 0.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3360 -1.9940 0.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6640 -3.0790 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6750 -3.8200 -1.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3360 -3.4730 -1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -4.2580 -1.7540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4340 -5.3700 -2.4460 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1980 -5.7210 -2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 -4.8210 -2.4010 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 -3.9730 -1.7730 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8470 -6.9100 -3.6730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4800 -7.1490 -4.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8010 -8.2560 -4.7840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 -9.1280 -5.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -8.8940 -4.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8430 -7.7930 -4.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2180 -10.5190 -6.1500 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.5850 1.1440 -0.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3710 0.6300 -2.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 1.6990 -0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8550 -1.1880 -0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -0.8950 1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4970 0.2540 1.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 0.8080 1.6650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8330 -0.0620 -0.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7660 -0.7920 0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1180 -1.4230 0.6260 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7010 -3.3480 -0.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9390 -4.6640 -1.8820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2550 -6.4700 -3.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8290 -8.4420 -5.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 -9.5770 -5.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8720 -7.6140 -3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 10 11 2 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 2 0 0 0 0 13 17 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 24 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 M END