IFLAB-ZINC04568655 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 65 0 0 1 0 0 0 0 0999 V2000 3.6620 3.7620 0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8020 4.3460 0.7880 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6950 5.4130 1.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4370 5.8960 2.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3000 5.3060 1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4140 4.2400 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1750 3.6000 0.0480 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3180 3.8440 0.6760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9360 4.1250 -1.3690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6760 5.5660 -1.3180 N 0 0 0 0 0 0 0 0 0 0 0 0 0.3570 6.2330 -2.4450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 5.6400 -3.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0920 7.7030 -2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1630 8.2950 -1.3380 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 8.3700 -3.5210 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4870 9.8100 -3.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 10.3170 -4.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 11.8000 -4.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 12.6030 -5.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 14.0990 -5.0690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6930 14.5200 -5.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4590 13.7250 -4.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 12.2520 -4.4700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1840 1.4870 -0.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -0.0220 -0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7160 -0.5210 0.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8480 0.0950 1.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 1.6050 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 6.9390 2.8850 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9690 7.3520 2.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6430 6.1540 2.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7470 2.9320 -0.4190 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7760 3.9700 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3230 5.6780 1.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8180 3.9360 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0760 3.6150 -1.8050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7320 6.0400 -0.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2840 7.8960 -4.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3270 10.0050 -2.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 10.3270 -3.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 10.1230 -5.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7090 9.8010 -5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8440 12.1690 -5.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2340 14.4830 -4.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2990 14.5120 -5.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7760 15.5860 -4.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 14.3030 -6.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9600 13.8290 -3.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 14.0980 -3.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1290 12.1280 -5.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8560 11.6480 -3.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0260 1.8810 -1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6990 1.6780 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -0.5180 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -0.2160 -1.3310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9840 -0.3170 2.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 -0.0960 0.6560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7510 1.7980 1.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4940 2.0850 1.7720 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0560 8.1320 1.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3700 7.6950 3.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3520 2.1420 0.0070 N 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 32 1 0 0 0 0 2 3 2 0 0 0 0 2 33 1 0 0 0 0 3 4 1 0 0 0 0 3 31 1 0 0 0 0 4 5 2 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 34 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 62 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 17 42 1 0 0 0 0 18 19 2 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 20 45 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 48 1 0 0 0 0 22 49 1 0 0 0 0 23 50 1 0 0 0 0 23 51 1 0 0 0 0 24 25 1 0 0 0 0 24 52 1 0 0 0 0 24 53 1 0 0 0 0 24 62 1 0 0 0 0 25 26 1 0 0 0 0 25 54 1 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 56 1 0 0 0 0 27 57 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 28 62 1 0 0 0 0 29 30 1 0 0 0 0 30 31 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 M END