IBS-ZINC05454857 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.0070 1.4830 -0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 0.2930 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -0.5640 -1.0640 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6580 -0.8910 -1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0210 -1.7860 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4300 0.2270 -1.7230 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0030 -0.2250 -2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 -0.4330 -2.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 -0.8900 -4.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2020 -1.1400 -5.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7540 -0.9110 -5.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2090 -0.4630 -3.9730 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8450 -0.3390 -4.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 0.0650 -3.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 0.0790 -3.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7320 -0.3090 -5.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7050 -0.7100 -6.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -0.7320 -5.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7990 -1.0610 -6.0500 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8080 -1.6120 -6.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2890 -1.9860 -7.3900 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4660 -1.1130 -4.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1970 -0.1610 -1.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7700 -1.4560 -1.1900 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0330 -1.8580 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5580 -3.0460 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8200 -3.8330 -0.2440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5560 -3.4300 0.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0340 -2.2390 -0.3200 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4790 -5.3250 0.3490 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.7280 2.0090 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8180 1.1260 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 2.1620 0.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4280 0.6560 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -0.3080 0.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 -1.4820 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -2.5210 -0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -2.2250 -1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7160 1.0700 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0320 0.3670 -2.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3160 0.3930 -3.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7400 -0.2940 -5.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 -1.0100 -7.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6870 -2.1370 -3.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8360 -0.9440 -5.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9530 -0.4190 -3.4380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0100 0.5180 -1.9630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5740 0.2930 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6090 -1.2440 -2.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5450 -3.3600 -1.4180 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 -4.0440 0.8240 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0490 -1.9230 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 34 1 0 0 0 0 2 35 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 39 1 0 0 0 0 7 8 2 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 23 1 0 0 0 0 9 10 2 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 1 0 0 0 0 11 19 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 16 17 2 0 0 0 0 16 42 1 0 0 0 0 17 18 1 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 20 21 3 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 51 1 0 0 0 0 29 52 1 0 0 0 0 M END