IBS-ZINC02373259 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 47 0 0 1 0 0 0 0 0999 V2000 -1.7170 1.0620 2.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 -0.3700 2.0770 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3480 -0.7820 0.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 0.0300 -0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4010 -2.2040 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6210 -2.8000 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8070 -2.1560 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9000 -2.8370 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9770 -2.3100 -0.4910 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6890 -4.3300 -0.4140 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.2930 -4.8550 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9110 -4.5320 -0.0610 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.0160 -4.8250 -1.8250 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9160 -6.3280 -1.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0260 -7.1030 -1.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9350 -8.4810 -1.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7320 -9.0860 -1.9400 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6220 -8.3110 -2.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7150 -6.9320 -2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -8.9580 -2.5600 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2540 -10.1730 -2.5920 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 -8.2760 -2.8070 O 0 5 0 0 0 0 0 0 0 0 0 0 -3.8700 -0.7610 0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 0.0500 -0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4610 1.4240 -0.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9920 1.9920 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4610 1.1860 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4080 -0.1890 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2010 -2.9850 0.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 -3.6050 0.5010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 1.2030 3.4090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7150 1.4800 2.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 1.5670 1.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8960 -1.0210 2.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0280 -4.5210 -2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3090 -4.3940 -2.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9660 -6.6300 -1.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8020 -9.0860 -1.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6600 -10.1630 -1.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8490 -6.3270 -2.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9830 -0.3920 -1.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0940 2.0560 -1.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0390 3.0660 0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8750 1.6320 2.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7790 -0.8170 2.0550 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 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 7 23 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 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 41 1 0 0 0 0 25 26 1 0 0 0 0 25 42 1 0 0 0 0 26 27 2 0 0 0 0 26 43 1 0 0 0 0 27 28 1 0 0 0 0 27 44 1 0 0 0 0 28 45 1 0 0 0 0 29 30 3 0 0 0 0 M CHG 1 20 1 M CHG 1 22 -1 M END