IBS-ZINC05477612 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 -0.3760 1.0990 0.1940 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.3840 0.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -0.6440 -1.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0420 -0.6440 -1.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2250 -0.9240 -2.6470 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -1.0970 -3.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -0.9420 -2.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 -1.0880 -2.6920 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.5570 -1.4890 -4.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9620 -1.6640 -4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6540 -0.5790 -5.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9420 -0.7400 -5.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5390 -1.9860 -5.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8480 -3.0720 -5.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 -2.9130 -4.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6860 -4.2780 -4.3250 Cl 0 0 0 0 0 0 0 0 0 0 0 0 3.0960 -0.3790 -0.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4090 -0.7890 -0.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3880 -0.5380 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0710 0.1180 1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7720 0.5260 1.7440 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 0.2860 0.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4360 1.2390 3.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5300 1.7030 0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0320 1.3570 -0.6370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8890 1.2920 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 -0.6420 0.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9110 -0.9880 0.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 -0.6790 -4.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9980 -2.4130 -4.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 0.3950 -5.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4820 0.1090 -6.3450 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5460 -2.1110 -6.2930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3150 -4.0460 -5.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 -1.3010 -1.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4040 -0.8550 0.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8410 0.3110 2.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 0.6100 1.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5540 2.3140 2.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4040 1.0210 3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1050 0.8990 3.8190 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 27 1 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 7 1 0 0 0 0 4 5 2 0 0 0 0 4 17 1 0 0 0 0 5 6 1 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 13 14 2 0 0 0 0 13 33 1 0 0 0 0 14 15 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 35 1 0 0 0 0 19 20 1 0 0 0 0 19 36 1 0 0 0 0 20 21 2 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 M END