ANALYTICONDISCOVERY-ZINC04277975 MOE2007 3D CORINA 3.40 0006 02.08.2006 71 75 0 0 1 0 0 0 0 0999 V2000 0.0070 5.4550 2.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6650 5.3640 3.3810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8170 4.1350 4.0280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 3.0010 3.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 3.0570 2.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5480 4.3130 1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 1.7210 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 0.9060 2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 1.6850 3.8030 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 1.3450 4.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5470 1.2730 0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0710 1.4900 0.7060 C 0 0 3 0 0 0 0 0 0 0 0 0 3.3160 2.4900 1.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6660 1.3440 -0.7060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4310 0.4300 -1.0150 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2940 2.2930 -1.6230 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6620 2.2230 -2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 3.0670 -1.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 0.4810 1.5540 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0510 0.6900 2.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9390 1.7810 3.4350 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6020 -0.5630 3.6010 C 0 0 3 0 0 0 0 0 0 0 0 0 4.2390 -1.4290 3.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1380 -0.6180 3.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8500 0.0600 4.6460 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0190 0.7510 5.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8410 -0.1150 6.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0500 -0.6610 4.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -1.2520 5.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1620 -1.6530 4.1280 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2330 -1.3580 6.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7320 -2.0080 7.5640 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 -1.8780 8.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -1.1560 8.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7070 -0.6460 6.7680 S 0 0 0 0 0 0 0 0 0 0 0 0 8.2330 0.0720 4.8080 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7880 0.6120 5.7670 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0780 -0.5760 3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3910 -1.1260 4.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2930 -1.6860 3.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2790 -0.1060 1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3730 0.4640 2.6200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1130 6.4210 1.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0800 6.2620 3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3400 4.0650 4.9750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0670 4.4000 0.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4190 -0.1640 3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 0.2110 0.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1190 1.8070 -0.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9330 -0.4050 1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4340 -1.6730 3.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5100 -0.2330 2.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6060 1.0340 6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6780 1.6820 5.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2240 -0.9740 6.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1860 0.4600 6.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6640 -2.5580 7.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0720 -2.3020 9.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 -0.9110 9.0630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5430 -1.4220 3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9310 -0.3370 4.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1720 -1.9100 5.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2740 -1.9670 3.6000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8440 -2.5470 2.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8090 -0.9350 1.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5850 0.6630 0.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4450 0.8220 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8470 1.3480 3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5190 -0.6300 2.1770 N 0 3 0 0 0 0 0 0 0 0 0 0 12.0430 0.1490 2.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1350 -1.0070 1.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 43 1 0 0 0 0 2 3 2 0 0 0 0 2 44 1 0 0 0 0 3 4 1 0 0 0 0 3 45 1 0 0 0 0 4 5 2 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 46 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 47 1 0 0 0 0 9 10 1 0 0 0 0 11 12 1 0 0 0 0 11 48 1 0 0 0 0 11 49 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 19 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 19 20 1 0 0 0 0 19 50 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 28 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 36 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 28 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 28 29 1 0 0 0 0 29 30 2 0 0 0 0 29 31 1 0 0 0 0 31 32 2 0 0 0 0 31 35 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 34 2 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 36 37 2 0 0 0 0 36 38 1 0 0 0 0 38 39 1 0 0 0 0 38 42 1 0 0 0 0 38 60 1 0 0 0 0 39 40 1 0 0 0 0 39 61 1 0 0 0 0 39 62 1 0 0 0 0 40 63 1 0 0 0 0 40 64 1 0 0 0 0 40 69 1 0 0 0 0 41 42 1 0 0 0 0 41 65 1 0 0 0 0 41 66 1 0 0 0 0 41 69 1 0 0 0 0 42 67 1 0 0 0 0 42 68 1 0 0 0 0 69 70 1 0 0 0 0 69 71 1 0 0 0 0 M CHG 1 69 1 M END