NCID-ZINC05459802 MOE2007 3D CORINA 3.40 0006 02.08.2006 76 76 0 0 1 0 0 0 0 0999 V2000 0.6510 1.7980 1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9490 0.5230 2.0400 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9100 0.2150 2.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2240 -0.1610 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6640 2.6750 1.4780 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4990 4.0780 1.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8650 4.7000 0.7500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 6.1240 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0960 6.7430 -0.1860 C 0 0 3 0 0 0 0 0 0 0 0 0 4.7690 6.7350 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8180 8.2220 -0.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0590 8.3630 -1.6070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7280 5.9690 -1.2680 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0970 5.8660 -1.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9250 6.4140 -0.7110 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4760 5.0020 -2.6580 C 0 0 3 0 0 0 0 0 0 0 0 0 6.0240 4.0080 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0510 5.7190 -3.9490 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2530 5.5910 -4.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4320 5.5920 -3.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9270 4.8650 -2.7700 N 0 0 0 0 0 0 0 0 0 0 0 0 8.6510 4.1050 -1.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1090 3.3160 -1.0940 O 0 0 0 0 0 0 0 0 0 0 0 0 10.1590 4.3880 -1.7790 C 0 0 3 0 0 0 0 0 0 0 0 0 10.6000 4.5640 -2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3240 5.6250 -0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 11.7760 5.9650 -0.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8540 7.1650 0.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2830 7.3740 0.8510 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7980 3.2220 -1.1850 N 0 0 0 0 0 0 0 0 0 0 0 0 12.0670 2.7940 -1.5010 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7650 3.3260 -2.3650 O 0 0 0 0 0 0 0 0 0 0 0 0 12.5970 1.6590 -0.5980 C 0 0 3 0 0 0 0 0 0 0 0 0 12.8550 2.1340 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5320 0.5690 -0.3530 C 0 0 3 0 0 0 0 0 0 0 0 0 11.1250 0.2100 -1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0590 -0.6080 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4460 1.1640 0.3800 O 0 0 0 0 0 0 0 0 0 0 0 0 9.7940 0.4600 0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6070 2.3260 1.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8750 4.0930 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0070 4.6260 1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4770 4.7040 1.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3860 4.0600 0.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0750 6.1040 -0.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 6.7570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1030 5.5490 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1510 5.2740 -4.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8380 6.7810 -3.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2030 4.6350 -5.4110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3070 6.3940 -5.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3110 5.1130 -4.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6890 6.6070 -3.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8510 6.4920 -1.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7820 5.4620 0.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2610 5.1130 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3300 6.1750 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4820 8.0620 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2070 6.9960 1.2570 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6770 6.5010 1.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9500 7.6350 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2650 2.6850 -0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4460 -0.2690 1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2510 -1.3150 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8500 -1.1480 -0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 2.1510 1.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 3.0980 1.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 1.4930 1.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3740 9.1020 0.1180 O 0 5 0 0 0 0 0 0 0 0 0 0 13.3170 8.5000 1.8070 N 0 3 0 0 0 0 0 0 0 0 0 0 14.2710 8.6650 2.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7160 8.3320 2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9900 9.3690 1.3640 H 0 0 0 0 0 0 0 0 0 0 0 0 13.8350 1.1280 -1.2010 N 0 0 0 0 0 0 0 0 0 0 0 0 14.4290 1.9250 -1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6110 0.7000 -2.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 66 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 8 46 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 13 1 0 0 0 0 11 12 2 0 0 0 0 11 69 1 0 0 0 0 13 14 1 0 0 0 0 13 47 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 21 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 30 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 29 70 1 0 0 0 0 30 31 1 0 0 0 0 30 62 1 0 0 0 0 31 32 2 0 0 0 0 31 33 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 33 74 1 0 0 0 0 35 36 1 0 0 0 0 35 37 1 0 0 0 0 35 38 1 0 0 0 0 37 63 1 0 0 0 0 37 64 1 0 0 0 0 37 65 1 0 0 0 0 38 39 1 0 0 0 0 66 67 1 0 0 0 0 66 68 1 0 0 0 0 70 71 1 0 0 0 0 70 72 1 0 0 0 0 70 73 1 0 0 0 0 74 75 1 0 0 0 0 74 76 1 0 0 0 0 M CHG 1 2 1 M CHG 1 69 -1 M CHG 1 70 1 M END