NCID-ZINC04880509 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 56 0 0 1 0 0 0 0 0999 V2000 -0.0090 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7050 -0.5010 1.1820 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -1.6700 1.4760 C 0 0 3 0 0 0 0 0 0 0 0 0 0.1620 -2.4220 0.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1660 -2.3300 2.8180 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5240 -3.1690 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5400 -2.8020 2.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2510 -2.3210 1.6890 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.2830 -2.0700 1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -1.0780 1.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6380 -0.2960 2.0670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3660 -0.5070 0.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2040 -3.3150 0.6140 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2700 -4.2960 0.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5360 -4.9980 -0.6010 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6500 -4.5090 -1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0930 -3.4320 -0.4190 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1970 -2.7640 -0.7850 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.0250 -4.3610 -3.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8700 -3.1020 -1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4980 -4.1390 -2.6400 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3920 -4.8600 -2.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -5.7940 -3.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -1.3180 3.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0560 -1.9970 5.2200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2630 -1.2430 6.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -0.0500 6.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2470 -1.8120 7.5380 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -1.0480 8.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1860 0.2890 8.7300 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4940 1.0400 9.8470 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1720 0.4630 10.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -0.8690 10.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2330 -1.6270 9.7350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3940 -1.5890 12.1790 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 -0.5110 -1.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0160 1.8950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5350 1.8900 -0.8720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5150 1.8810 0.9080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -4.4660 1.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7540 -2.5390 -2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0650 -0.8570 3.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6840 -0.5490 3.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -2.7500 7.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3430 0.7410 7.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2050 2.0800 9.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4120 1.0530 11.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -2.6680 9.6920 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7210 -0.1550 -1.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6840 -1.6020 -1.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -0.1400 -2.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 2 3 1 0 0 0 0 2 13 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 11 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 25 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 14 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 41 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 23 1 0 0 0 0 18 19 1 0 0 0 0 19 21 2 0 0 0 0 20 22 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 26 27 1 0 0 0 0 27 28 2 0 0 0 0 27 29 1 0 0 0 0 29 30 1 0 0 0 0 29 45 1 0 0 0 0 30 31 1 0 0 0 0 30 35 2 0 0 0 0 31 32 2 0 0 0 0 31 46 1 0 0 0 0 32 33 1 0 0 0 0 32 47 1 0 0 0 0 33 34 2 0 0 0 0 33 48 1 0 0 0 0 34 35 1 0 0 0 0 34 36 1 0 0 0 0 35 49 1 0 0 0 0 37 50 1 0 0 0 0 37 51 1 0 0 0 0 37 52 1 0 0 0 0 M END