IBS-ZINC05186593 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 42 0 0 1 0 0 0 0 0999 V2000 0.1980 1.4990 -0.1400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0000 -0.0120 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3940 -0.5130 -0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4690 -0.3160 0.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8950 -0.7920 1.1630 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 -0.0580 -0.8800 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7080 -0.3760 -0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0120 -0.7640 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6500 -0.4910 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9770 -0.7760 -0.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 -1.3400 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -1.6190 1.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7140 -1.3190 2.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9530 -2.1580 2.7920 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1830 -2.2740 2.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2900 -2.7760 2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2180 -3.2570 4.2260 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7210 -4.5220 4.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6480 -4.9660 5.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0810 -4.1660 6.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5820 -2.9160 6.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6510 -2.4530 5.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0300 -0.8810 4.8250 Cl 0 0 0 0 0 0 0 0 0 0 0 0 8.4320 -5.5270 3.3360 Cl 0 0 0 0 0 0 0 0 0 0 0 0 6.1000 -1.7570 0.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9940 -1.6880 0.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2600 1.7190 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3310 1.8540 -1.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 2.0000 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8130 -1.4420 -0.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0920 0.1940 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 -0.1200 -1.5750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0940 -0.0550 -1.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4700 -0.5640 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2110 -1.5220 3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2250 -2.8220 2.3010 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0360 -5.9400 6.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0280 -4.5200 7.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1410 -2.2990 7.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 34 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 26 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 37 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 25 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 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 26 27 2 0 0 0 0 M END