IBS-ZINC04273374 MOE2007 3D CORINA 3.40 0006 02.08.2006 72 74 0 0 1 0 0 0 0 0999 V2000 0.0680 2.1780 -0.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2100 0.6530 -0.5850 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8660 -0.0180 0.3060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6960 0.2650 1.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6820 -0.1700 2.3010 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7790 -1.2540 2.1430 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8620 0.5180 1.5410 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6390 0.2980 -0.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7190 -0.7960 -0.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 0.8730 -0.9100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 0.3710 -2.3520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 0.6070 -2.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1140 1.2530 -4.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1320 0.0470 -2.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.3470 -1.0290 -1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2430 0.1560 -2.6930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9920 -0.9050 -3.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2930 -0.8720 -3.6420 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0570 -1.9300 -3.9200 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3310 -1.5360 -4.5440 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2600 -0.1150 -4.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 0.3080 -4.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7100 1.4770 -4.0660 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1650 -0.2210 1.9690 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0080 2.0130 1.9460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6730 2.1640 3.2140 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9130 3.4580 3.5750 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 4.4390 2.9350 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6930 3.4920 4.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2560 4.8810 5.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1320 4.8580 6.3770 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1780 4.1550 6.2900 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7640 0.1090 3.7120 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2310 -0.8280 4.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3080 -1.8670 4.1920 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4020 -0.3760 5.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1570 -1.3970 6.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0320 -0.9940 8.4280 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4730 0.1370 8.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0550 2.3860 -1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6630 2.7180 -1.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 2.6430 0.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -1.1070 0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8720 0.3030 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4770 -0.2740 2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8790 1.3210 2.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7450 0.5750 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 1.9670 -0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8510 -0.7060 -2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4140 0.8550 -2.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9740 1.6160 -4.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 1.4410 -4.5380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 1.1620 -2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6000 -1.9000 -2.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7940 -2.9580 -3.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1920 -1.8260 -3.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4370 -1.9450 -5.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2580 -0.2900 3.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0600 0.2920 1.6030 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1850 -1.2470 1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 2.4970 2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6010 2.5490 1.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5080 2.7620 4.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0270 3.1870 5.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4420 5.6060 5.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8640 5.2220 4.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1160 0.5820 6.0960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4720 -0.2250 6.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3560 -2.3570 6.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2210 -1.5700 6.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 5.5840 7.3270 O 0 5 0 0 0 0 0 0 0 0 0 0 0.4670 -1.8630 9.2370 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 2 3 1 0 0 0 0 2 8 1 0 0 0 0 2 14 1 0 0 0 0 3 4 1 0 0 0 0 3 43 1 0 0 0 0 3 44 1 0 0 0 0 4 5 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 33 1 0 0 0 0 7 8 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 47 1 0 0 0 0 10 48 1 0 0 0 0 11 12 1 0 0 0 0 11 49 1 0 0 0 0 11 50 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 13 51 1 0 0 0 0 13 52 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 16 17 2 0 0 0 0 16 53 1 0 0 0 0 17 18 1 0 0 0 0 17 54 1 0 0 0 0 18 19 2 0 0 0 0 18 22 1 0 0 0 0 19 20 1 0 0 0 0 19 55 1 0 0 0 0 20 21 1 0 0 0 0 20 56 1 0 0 0 0 20 57 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 24 58 1 0 0 0 0 24 59 1 0 0 0 0 24 60 1 0 0 0 0 25 26 1 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 31 1 0 0 0 0 30 65 1 0 0 0 0 30 66 1 0 0 0 0 31 32 2 0 0 0 0 31 71 1 0 0 0 0 33 34 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 36 37 1 0 0 0 0 36 67 1 0 0 0 0 36 68 1 0 0 0 0 37 38 1 0 0 0 0 37 69 1 0 0 0 0 37 70 1 0 0 0 0 38 39 2 0 0 0 0 38 72 1 0 0 0 0 M CHG 1 71 -1 M CHG 1 72 -1 M END