IFLAB-ZINC04387857 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 66 0 0 1 0 0 0 0 0999 V2000 3.1620 2.5640 1.8210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8270 2.1620 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4100 0.8040 1.5850 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6640 0.6630 2.8400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8300 0.8740 2.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6120 -0.3500 0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -1.3750 1.0500 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6790 -0.3380 -0.2760 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8780 0.6940 -0.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 -1.0690 -1.5320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1850 -2.1300 -1.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9570 -2.4310 -0.6090 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9660 -2.7810 -0.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -1.0370 0.0670 C 0 0 3 0 0 0 0 0 0 0 0 0 4.4290 -1.1310 1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7650 -2.2370 2.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8680 -3.6160 1.6850 C 0 0 3 0 0 0 0 0 0 0 0 0 4.9400 -3.8470 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -3.5430 0.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 2.2130 -3.3320 0.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 -4.9130 -0.4500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -6.0180 0.3280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3170 -6.0720 1.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7740 -7.1310 2.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2350 -4.7740 2.5600 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7520 -4.5100 2.8870 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0630 -4.9530 3.8760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 -5.8340 4.9630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2620 -5.9260 6.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4610 -5.5400 6.1910 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1680 -0.2080 -0.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9780 1.9660 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3760 3.6140 1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1650 2.4400 2.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0530 2.8580 1.5620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8570 2.2630 0.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8330 -0.3380 3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0580 1.3800 3.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0420 1.8780 2.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 0.1530 1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3570 0.7530 3.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1780 -1.5380 -1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0230 -0.3660 -2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7060 -3.0000 -2.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8690 -1.7280 -2.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5120 -1.3060 1.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2580 -0.1740 2.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2600 -2.2430 3.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7260 -1.9840 2.5660 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0230 -4.8970 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 -5.1480 -0.5550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6740 -5.8700 0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9360 -6.9810 -0.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1770 -4.2010 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -5.4150 3.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6400 -3.7270 3.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0570 -5.3450 3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2410 -3.9800 4.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4570 -5.4340 5.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -6.8550 4.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2880 0.7670 -0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1320 -0.7260 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9630 -0.0170 -1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6200 -6.3840 7.2430 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 4 37 1 0 0 0 0 4 38 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 14 1 0 0 0 0 10 11 1 0 0 0 0 10 42 1 0 0 0 0 10 43 1 0 0 0 0 11 12 1 0 0 0 0 11 44 1 0 0 0 0 11 45 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 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 52 1 0 0 0 0 22 53 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 57 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 2 0 0 0 0 29 64 1 0 0 0 0 31 61 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 M CHG 1 64 -1 M END