IBS-ZINC01274196 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 59 0 0 0 0 0 0 0 0999 V2000 -0.0380 1.6690 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 0.2000 -0.1890 N 0 3 0 0 0 0 0 0 0 0 0 0 0.8760 -0.2830 0.8690 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -0.3060 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8770 0.1930 1.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2320 -0.3120 1.6480 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8900 0.0090 2.8140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1910 -0.4740 3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8110 -0.1420 4.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1510 0.6410 5.1320 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.9140 1.0920 4.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3440 1.8030 5.6730 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2980 0.7710 3.7260 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.8060 0.9660 6.4030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2790 1.3080 6.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9250 0.1160 5.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1830 -0.5950 4.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7460 -1.6960 3.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.0390 -2.0810 4.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7650 -1.3720 5.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.2050 -0.2750 5.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.5980 -3.1560 3.5820 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4570 -0.2790 -1.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8420 0.2580 -1.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0080 1.4310 -2.4600 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 1.9230 -2.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3830 1.2420 -2.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2180 0.0700 -1.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -0.4210 -1.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7390 -1.8900 -0.3660 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.9800 2.0450 -0.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 2.0280 -1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 2.0240 0.7550 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 0.0760 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -1.3730 0.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 0.0890 0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0450 0.0520 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3670 -1.3960 0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2120 -0.1650 2.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 1.2830 1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -0.8720 0.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6870 -1.0950 2.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7490 0.1090 7.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3120 1.8230 6.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7870 1.5260 7.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3400 2.1740 5.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1810 -2.2470 3.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7720 -1.6780 5.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7740 0.2730 6.5140 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4450 -3.9950 4.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4840 -1.3690 -1.4910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2170 0.0660 -2.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 1.9630 -2.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4070 2.8400 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3750 1.6270 -2.4030 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0810 -0.4620 -1.1350 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 4 1 0 0 0 0 2 23 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 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 6 1 0 0 0 0 5 39 1 0 0 0 0 5 40 1 0 0 0 0 6 7 1 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 2 0 0 0 0 8 42 1 0 0 0 0 9 10 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 15 45 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 22 50 1 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 27 28 2 0 0 0 0 27 55 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 M CHG 1 2 1 M END