CHEMDIV-ZINC04885228 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 51 0 0 1 0 0 0 0 0999 V2000 -0.8930 1.1090 -0.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3460 -0.2990 0.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6130 -0.4020 1.3140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4140 0.3390 1.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2520 -1.7890 1.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0850 -0.1290 2.5660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5410 0.4730 3.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7290 0.7730 3.6610 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2850 0.7400 4.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6400 1.0250 4.7590 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3460 1.2990 5.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7160 1.2980 7.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 1.0160 7.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3480 0.7480 6.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 0.9980 8.4030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.2720 1.2640 9.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 1.5350 9.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3630 1.5660 8.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1200 1.9880 8.4770 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.8100 0.3030 8.3750 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0340 0.4410 7.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8030 0.3450 6.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2760 1.8480 10.9930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4200 1.4810 12.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0200 1.9230 11.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6070 1.1970 10.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0810 1.8300 -0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5330 1.1460 -0.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4930 1.4270 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1860 -0.9930 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1790 -0.5940 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -1.8610 2.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 -2.5680 1.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8020 -2.0060 0.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -0.4210 2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1680 1.0700 3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 1.5150 5.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4150 0.5380 6.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1050 -0.4120 7.9390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0860 -0.0440 9.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 2.9250 11.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 1.3150 11.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 1.9480 13.1050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4500 0.3950 12.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0570 3.0080 11.8400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6170 1.7030 12.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 0.1390 11.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5910 1.6220 10.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1360 0.5890 8.0730 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 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 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 31 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 32 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 8 2 0 0 0 0 7 9 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 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 18 2 0 0 0 0 13 14 1 0 0 0 0 13 15 2 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 26 1 0 0 0 0 17 18 1 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 22 2 0 0 0 0 21 49 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 25 26 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 M CHG 1 49 -1 M END