NCID-ZINC05439481 MOE2007 3D CORINA 3.40 0006 02.08.2006 77 82 0 0 1 0 0 0 0 0999 V2000 -0.2210 1.2550 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -0.2580 0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1960 -0.9760 -0.9940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -0.6840 1.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3200 -1.4810 1.3530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 -0.1790 2.6620 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8940 -0.6340 3.7930 C 0 0 3 0 0 0 0 0 0 0 0 0 1.2580 -1.6470 3.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0810 0.3380 4.0610 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5260 0.6790 3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3760 1.4970 4.7910 C 0 0 3 0 0 0 0 0 0 0 0 0 2.3170 2.3220 5.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4700 3.3040 6.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 2.5660 7.4130 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0920 1.9390 8.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 1.6760 6.6100 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0810 2.2980 5.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 0.7680 5.7470 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0610 -0.5660 5.1050 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.9460 -0.9840 5.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 -0.4800 6.3140 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3210 0.8820 7.5820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1190 1.8600 8.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7920 3.2940 8.0290 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.0420 3.4280 6.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 3.5520 8.2360 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.0090 4.9840 7.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 5.9620 8.6250 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3260 5.6700 8.4310 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5850 5.7890 7.3790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 4.2780 8.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1080 6.5960 9.2300 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4680 7.7510 8.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1390 7.9800 7.5060 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2810 8.7610 9.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 3.3980 9.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6280 2.3900 3.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -0.3070 4.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3150 0.3710 5.2360 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2380 -0.2330 6.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9640 -1.5140 6.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7770 -2.0690 7.2690 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8070 -2.1260 6.2470 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 -1.5330 5.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8300 1.5120 -0.0780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7820 1.5630 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6160 1.7660 0.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 -0.5150 0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2480 -0.7190 -1.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -2.0540 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -0.6680 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8720 1.6650 6.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0120 2.8760 5.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1310 3.9330 7.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8950 3.9340 5.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0070 0.2470 7.0220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 0.2630 8.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1860 1.6760 8.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8520 1.7180 9.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0520 5.1920 7.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2640 5.0980 6.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 5.8490 9.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6220 6.9830 8.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 4.0860 8.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3430 4.1540 9.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4800 8.3820 10.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7270 9.6970 9.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2250 8.9350 8.8970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0980 3.6010 9.8640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 4.1010 10.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 2.3800 10.0390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1050 1.7940 3.2550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1170 3.1860 4.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3360 2.8270 3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5010 1.3540 4.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1660 0.2660 6.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -2.0450 5.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 45 1 0 0 0 0 1 46 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 48 1 0 0 0 0 3 49 1 0 0 0 0 3 50 1 0 0 0 0 3 51 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 38 1 0 0 0 0 11 12 1 0 0 0 0 11 18 1 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 52 1 0 0 0 0 12 53 1 0 0 0 0 13 14 1 0 0 0 0 13 54 1 0 0 0 0 13 55 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 22 1 0 0 0 0 18 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 22 23 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 24 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 31 1 0 0 0 0 26 27 1 0 0 0 0 26 36 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 27 61 1 0 0 0 0 28 29 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 29 30 1 0 0 0 0 29 31 1 0 0 0 0 29 32 1 0 0 0 0 31 64 1 0 0 0 0 31 65 1 0 0 0 0 32 33 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 35 66 1 0 0 0 0 35 67 1 0 0 0 0 35 68 1 0 0 0 0 36 69 1 0 0 0 0 36 70 1 0 0 0 0 36 71 1 0 0 0 0 37 72 1 0 0 0 0 37 73 1 0 0 0 0 37 74 1 0 0 0 0 38 39 1 0 0 0 0 38 44 2 0 0 0 0 39 40 2 0 0 0 0 39 75 1 0 0 0 0 40 41 1 0 0 0 0 40 76 1 0 0 0 0 41 42 2 0 0 0 0 41 43 1 0 0 0 0 43 44 1 0 0 0 0 44 77 1 0 0 0 0 M END