IBS-ZINC02395191 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 0 0 0 0 0 0 0 0999 V2000 -0.0630 1.1050 0.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 1.1300 2.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5940 1.9480 4.0540 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1180 1.9390 4.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8130 1.5880 2.9410 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5440 1.6780 3.2270 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.3180 2.2070 4.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 2.3000 5.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 2.7160 6.4540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 2.9900 7.3130 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7980 2.8870 6.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2370 2.5030 5.8040 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.9900 3.2810 8.2340 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8910 3.7210 9.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7140 4.1040 10.8050 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9260 4.0820 10.7430 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.1050 4.4720 11.9500 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8650 4.7190 13.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0100 3.9740 13.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7570 4.2200 14.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3670 5.2090 15.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2280 5.9530 15.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4730 5.7070 13.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3100 5.5160 16.7960 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 2.8280 6.8000 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1720 1.1680 1.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0460 0.0150 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 1.4840 0.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 1.4580 -0.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9880 1.2660 2.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3080 0.0740 3.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2380 1.5030 4.9840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2320 2.9730 3.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2610 2.8670 9.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2630 4.5620 9.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1400 4.5640 11.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3150 3.2030 12.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6480 3.6410 14.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 6.7240 15.8160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 6.2850 13.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 2.5540 6.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9540 3.1820 7.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 0.0850 1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 1.6450 0.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 1.5870 1.6400 N 0 0 0 0 0 0 0 0 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 4 5 2 0 0 0 0 4 8 1 0 0 0 0 5 6 1 0 0 0 0 5 26 1 0 0 0 0 6 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 9 10 1 0 0 0 0 9 25 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 14 35 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 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 25 41 1 0 0 0 0 25 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 M END