IBS-ZINC01841469 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 54 0 0 0 0 0 0 0 0999 V2000 0.0330 1.3450 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 0.0110 0.6540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 -0.7440 0.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4260 -0.0620 0.9480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6020 -0.7710 1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5830 -2.1540 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3870 -2.8360 0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2060 -2.1380 0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -0.6730 0.5110 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4650 0.0490 0.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -0.7780 0.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8460 0.0900 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6920 1.3790 0.0980 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7470 2.2220 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5840 3.6090 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6860 4.4240 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9560 3.8830 -0.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1410 2.5280 -0.3150 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0430 1.6810 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1830 0.2180 -0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2710 -0.3120 -0.3240 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 -0.5170 -0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1340 -1.9160 -0.0550 N 0 0 0 0 0 0 0 0 0 0 0 0 6.7400 -2.5330 0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9230 -3.9930 0.8570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5750 -4.6610 1.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7420 -6.0280 1.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2680 -6.7430 0.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6220 -6.0950 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4390 -4.7220 -0.2380 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7990 -4.0850 -1.2520 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9550 1.8950 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9020 1.8740 0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4420 1.0170 0.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5380 -0.2450 1.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5050 -2.7050 1.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3780 -3.9160 0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -2.6710 0.6870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2660 -1.6430 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7270 -1.4060 1.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5160 -1.4100 -0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 4.0400 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5610 5.4960 -0.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8080 4.5400 -0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1330 2.1170 -0.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1100 -1.9750 1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9470 -4.1070 2.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2460 -6.5430 2.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4050 -7.8140 0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2560 -6.6600 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3850 -3.7880 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 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 9 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 6 7 2 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 37 1 0 0 0 0 8 38 1 0 0 0 0 9 10 1 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 11 12 1 0 0 0 0 11 40 1 0 0 0 0 11 41 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 17 18 2 0 0 0 0 17 44 1 0 0 0 0 18 19 1 0 0 0 0 18 45 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 30 2 0 0 0 0 26 27 2 0 0 0 0 26 47 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 29 2 0 0 0 0 28 49 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 30 31 1 0 0 0 0 31 51 1 0 0 0 0 M END