CHEMDIV-ZINC04793551 MOE2007 3D CORINA 3.40 0006 02.08.2006 78 83 0 0 1 0 0 0 0 0999 V2000 0.5500 0.7810 -2.0880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1210 -0.4190 -1.4050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5750 -0.8180 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0600 -1.9980 0.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9310 -2.3250 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7970 -1.3220 -1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5160 -1.3420 -3.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3900 -2.4080 -3.3270 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5420 -3.4190 -2.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 -3.3900 -1.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1420 -2.8210 1.4230 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6570 -3.5770 1.4410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4750 -3.6000 1.3970 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4100 -4.3290 0.5770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -4.3630 2.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 -5.5600 2.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6080 -6.2300 3.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1070 -5.7070 5.1050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3830 -4.5150 5.0930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1530 -3.8430 3.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3840 -2.5710 3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -2.0260 4.9850 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0940 -2.0860 2.6820 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -0.8780 2.6920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6940 -2.7030 1.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1140 -1.8940 1.9790 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 -2.9030 -0.0740 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4960 -2.1720 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7480 -2.7860 0.1690 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9850 -1.9700 -0.1860 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3400 -1.4940 0.5560 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5430 -2.0280 1.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9510 -3.3440 0.8510 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9030 -4.3620 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7170 -3.8330 -0.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2730 -3.6210 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6250 -4.4670 -0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 13.9600 -4.7480 -0.8300 C 0 0 0 0 0 0 0 0 0 0 0 0 14.9710 -4.1840 -0.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6690 -3.3450 0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3300 -3.0680 1.2940 C 0 0 0 0 0 0 0 0 0 0 0 0 16.2500 -4.4520 -0.3580 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0010 0.4940 -3.0410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3240 1.4180 -2.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2840 1.3110 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3080 -0.2300 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4060 -0.5550 -3.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9580 -2.4450 -4.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2280 -4.2400 -2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9610 -4.1880 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8020 -5.9750 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1740 -7.1580 3.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2810 -6.2260 6.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -4.1140 6.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 -1.0490 2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -0.6040 3.7080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3380 -0.0460 2.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9130 -3.5640 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5580 -2.1970 -1.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3810 -1.1270 -0.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6380 -2.8360 1.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -3.8190 -0.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1920 -1.9700 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8590 -0.9370 0.1560 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9450 -0.5880 1.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6120 -1.2830 -0.4850 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3440 -1.2830 1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2810 -2.1150 2.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2550 -5.3000 0.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5620 -4.6150 1.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0010 -3.6280 -1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8960 -4.5540 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8580 -4.9020 -1.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2110 -5.3980 -1.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 15.4700 -2.9160 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1250 -2.4310 2.1500 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2090 -2.5210 0.5210 N 0 3 0 0 0 0 0 0 0 0 0 0 7.9480 -2.7050 1.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 43 1 0 0 0 0 1 44 1 0 0 0 0 1 45 1 0 0 0 0 2 3 1 0 0 0 0 2 6 1 0 0 0 0 3 4 2 0 0 0 0 3 46 1 0 0 0 0 4 5 1 0 0 0 0 4 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 7 8 1 0 0 0 0 7 47 1 0 0 0 0 8 9 2 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 49 1 0 0 0 0 10 50 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 23 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 25 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 52 1 0 0 0 0 18 19 2 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 28 29 1 0 0 0 0 28 59 1 0 0 0 0 28 60 1 0 0 0 0 29 30 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 30 77 1 0 0 0 0 31 32 1 0 0 0 0 31 65 1 0 0 0 0 31 66 1 0 0 0 0 31 77 1 0 0 0 0 32 33 1 0 0 0 0 32 67 1 0 0 0 0 32 68 1 0 0 0 0 33 34 1 0 0 0 0 33 36 1 0 0 0 0 34 35 1 0 0 0 0 34 69 1 0 0 0 0 34 70 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 35 77 1 0 0 0 0 36 37 1 0 0 0 0 36 41 2 0 0 0 0 37 38 2 0 0 0 0 37 73 1 0 0 0 0 38 39 1 0 0 0 0 38 74 1 0 0 0 0 39 40 2 0 0 0 0 39 42 1 0 0 0 0 40 41 1 0 0 0 0 40 75 1 0 0 0 0 41 76 1 0 0 0 0 77 78 1 0 0 0 0 M CHG 1 77 1 M END