IBS-ZINC02238980 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.1400 2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -0.9040 3.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4350 -0.1700 4.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4330 -0.6930 4.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9570 -1.9510 4.6380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9700 -2.5430 5.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4600 -3.7670 5.0620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9660 -4.4390 3.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9880 -3.8940 3.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4560 -2.6320 3.4980 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4960 -2.0850 2.7500 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.4390 -4.3400 5.8110 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9100 -5.6220 5.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 1.0750 4.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 1.0440 3.1670 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7750 2.1050 5.1200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 3.1990 5.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 3.2910 4.1090 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 4.2880 6.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6900 5.4230 5.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5720 6.4360 6.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 6.3280 7.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 5.2040 7.9770 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 4.1880 7.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 7.6060 9.0340 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7930 -0.1500 5.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3580 -2.0330 6.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 -5.4070 3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6180 -4.4280 2.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3190 -5.5470 4.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0840 -6.3330 5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6880 -5.9650 6.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 2.0310 5.8450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4040 5.5080 5.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 7.3140 6.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8570 5.1250 8.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6710 3.3140 7.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 19 1 0 0 0 0 6 7 1 0 0 0 0 6 15 2 0 0 0 0 7 8 2 0 0 0 0 7 18 1 0 0 0 0 8 9 1 0 0 0 0 8 39 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 40 1 0 0 0 0 11 12 1 0 0 0 0 11 16 1 0 0 0 0 12 13 2 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 16 17 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 49 1 0 0 0 0 28 50 1 0 0 0 0 M END