FDA-ZINC08101115 MOE2007 3D CORINA 3.40 0006 02.08.2006 80 82 0 0 1 0 0 0 0 0999 V2000 -4.4940 -2.8800 2.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9380 -3.0570 1.8420 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.0230 -3.9250 1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5060 -1.7950 1.1280 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.6000 -1.8720 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9530 -1.7120 -0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2830 -0.3840 -0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9490 0.7920 -0.0730 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2260 1.7480 -0.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6270 0.6070 1.3030 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7150 0.5600 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1930 -0.6210 1.9050 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.3740 1.8090 2.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9160 1.6570 3.4160 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.2540 0.6950 3.8170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5790 2.7820 4.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.4340 2.6140 5.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0670 4.1690 3.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5630 4.2700 4.0890 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.3620 4.2300 5.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7600 3.1790 3.3550 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.7460 3.1800 3.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3680 1.7570 3.5230 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0940 1.4070 4.5260 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7590 0.8520 2.5790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8050 1.1270 2.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6860 3.5190 1.9610 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3500 3.3880 1.4190 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7580 4.1990 1.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 3.5890 -0.1280 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.6050 4.6590 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9350 3.3740 -0.6710 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3180 4.2550 -0.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 2.1120 -0.1190 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3560 2.1080 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7390 2.1370 1.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6520 0.7570 -0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1830 2.2630 -0.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 4.6000 -2.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 2.7170 -0.7430 O 0 5 0 0 0 0 0 0 0 0 0 0 -6.5490 -4.6740 3.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0830 -3.8230 2.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -2.5550 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4200 -2.1410 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8650 -1.8370 -0.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3520 -2.5380 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7460 -0.3060 -1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3530 -0.3610 -1.2170 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2980 4.3770 2.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5860 4.9380 4.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 1.2030 1.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1770 2.9500 1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 0.7120 -1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0140 -0.0470 -0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6800 0.5050 -0.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6950 1.5100 -0.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 5.0840 -2.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8610 5.2140 -2.5130 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1880 4.3840 -3.9530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5760 -4.6300 4.2040 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5880 -5.4650 2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3360 -4.8160 4.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0360 3.3060 -2.1740 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.2970 2.7020 -2.5540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9630 2.8400 -2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 5.6130 3.6190 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1330 5.8240 3.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6830 6.3960 3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0910 5.6280 2.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0590 2.7530 4.0050 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.5580 3.5550 4.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5060 1.9070 4.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2440 2.7600 2.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 0.8340 0.1410 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.0260 1.7460 -0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9290 0.1090 -0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2230 0.8330 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.8090 -3.3680 3.0390 N 0 3 0 0 0 0 0 0 0 0 0 0 -6.7330 -2.6100 3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7950 -3.3780 2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 78 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 6 7 1 0 0 0 0 6 45 1 0 0 0 0 6 46 1 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 7 48 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 74 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 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 23 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 70 1 0 0 0 0 18 19 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 66 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 27 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 27 28 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 28 36 1 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 40 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 63 1 0 0 0 0 34 35 1 0 0 0 0 34 37 1 0 0 0 0 34 38 1 0 0 0 0 35 36 1 0 0 0 0 35 51 1 0 0 0 0 35 52 1 0 0 0 0 37 53 1 0 0 0 0 37 54 1 0 0 0 0 37 55 1 0 0 0 0 38 56 1 0 0 0 0 39 57 1 0 0 0 0 39 58 1 0 0 0 0 39 59 1 0 0 0 0 39 63 1 0 0 0 0 41 60 1 0 0 0 0 41 61 1 0 0 0 0 41 62 1 0 0 0 0 41 78 1 0 0 0 0 63 64 1 0 0 0 0 63 65 1 0 0 0 0 66 67 1 0 0 0 0 66 68 1 0 0 0 0 66 69 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 74 77 1 0 0 0 0 78 79 1 0 0 0 0 78 80 1 0 0 0 0 M CHG 1 40 -1 M CHG 1 63 1 M CHG 1 66 1 M CHG 1 70 1 M CHG 1 74 1 M CHG 1 78 1 M END