IBS-ZINC02229132 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -0.1480 -1.2300 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1220 -0.8900 -2.3850 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 -0.1480 -3.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0750 -0.6490 -4.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5040 -1.8920 -4.9170 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6600 -2.4620 -6.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0920 -3.6720 -6.4660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3550 -4.3520 -5.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -3.8290 -4.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7570 -2.5820 -3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5970 -2.0560 -2.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -4.2230 -7.7000 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -5.4910 -7.9240 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3030 1.0770 -2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 1.0280 -1.4230 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.0730 2.1060 -3.1880 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.3910 3.1820 -2.4400 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0080 3.2560 -1.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.2060 4.2700 -3.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5370 5.3850 -2.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2970 6.3980 -2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7320 6.3120 -4.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4080 5.2090 -4.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6430 4.1900 -4.3420 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9590 5.1090 -6.5190 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -1.6200 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9700 -0.1110 0.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -0.1000 -5.3370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2270 -1.9440 -6.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9140 -5.3090 -5.7280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6140 -4.3690 -3.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5480 -5.4030 -7.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0300 -6.2220 -7.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8220 -5.8170 -8.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3790 2.0470 -4.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1990 5.4540 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5540 7.2610 -2.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3280 7.1070 -4.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3870 3.3320 -4.9460 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 49 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 28 50 1 0 0 0 0 M END