IFLAB-ZINC04263175 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 72 0 0 1 0 0 0 0 0999 V2000 -0.2010 1.6190 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0070 0.1020 -0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6700 -0.4880 1.0730 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2910 -0.5640 2.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5130 -1.4160 1.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2870 -0.8640 0.7030 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0870 0.4020 1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2700 -1.9310 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -2.5570 3.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 -2.8760 4.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -2.5560 6.0090 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5800 -1.0610 6.0140 C 0 0 3 0 0 0 0 0 0 0 0 0 1.4720 -0.4300 5.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2920 -0.7400 4.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2500 -0.7770 7.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -1.5210 7.5320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0690 0.3680 8.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 0.3060 9.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0970 1.3570 10.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6000 2.4760 9.9000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0250 2.5470 8.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 1.4970 7.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 -2.9430 7.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -4.1120 7.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4850 -4.4700 8.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5710 -3.6710 9.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8400 -2.5200 8.6070 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 -2.1610 7.5340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -3.3630 6.0090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8830 -0.1880 -1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 2.1390 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 1.9940 -0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 1.9310 0.8270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -1.4930 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 0.1090 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5970 0.4510 2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1900 -2.4390 1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1920 -1.4930 2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4950 1.1650 1.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5160 0.8510 0.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9190 0.1650 1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0050 -2.1920 0.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8190 -1.5730 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7510 -2.8530 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 -2.7390 2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0760 -3.1540 3.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9740 -3.9430 4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6630 -2.3210 4.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2380 -1.2910 4.7970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5130 0.3320 4.7640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 -0.5620 9.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 1.3020 11.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8070 3.2970 10.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5620 3.4290 8.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0920 1.6060 6.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -4.7680 7.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2790 -5.3770 9.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2120 -3.9510 10.1720 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6960 -1.9010 8.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2800 -1.2640 6.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7410 -3.0670 6.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8700 0.2770 -1.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 -1.2640 -1.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4240 0.2030 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 -0.5910 -0.4320 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.8230 -0.0820 -1.1770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1080 -1.5000 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4500 -1.0870 3.5090 N 0 3 0 0 0 0 0 0 0 0 0 0 1.3330 -0.5570 3.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 30 1 0 0 0 0 2 65 1 0 0 0 0 3 4 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 68 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 65 1 0 0 0 0 7 39 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 9 68 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 23 1 0 0 0 0 11 29 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 14 49 1 0 0 0 0 14 50 1 0 0 0 0 14 68 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 51 1 0 0 0 0 19 20 1 0 0 0 0 19 52 1 0 0 0 0 20 21 2 0 0 0 0 20 53 1 0 0 0 0 21 22 1 0 0 0 0 21 54 1 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 56 1 0 0 0 0 25 26 1 0 0 0 0 25 57 1 0 0 0 0 26 27 2 0 0 0 0 26 58 1 0 0 0 0 27 28 1 0 0 0 0 27 59 1 0 0 0 0 28 60 1 0 0 0 0 29 61 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 30 64 1 0 0 0 0 65 66 1 0 0 0 0 65 67 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 65 1 M CHG 1 68 1 M END