CHEMDIV-ZINC06875235 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 1.1820 1.5080 1.0910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 0.0010 1.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0720 -0.6970 0.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -2.0780 0.6690 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2190 -2.7670 1.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3460 -2.0630 1.4710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -0.6810 1.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7730 -2.9190 1.9680 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -4.1660 1.0580 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0850 -4.8510 1.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9690 -4.2570 1.3320 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -6.3540 1.3530 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0280 -6.7310 0.8960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0780 -6.9280 0.6330 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6690 -6.2440 -0.4070 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7540 -6.7920 -1.0670 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2530 -8.0270 -0.6910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6740 -8.7200 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -8.1680 1.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9660 -8.8680 2.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2250 -10.0350 2.3910 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 -8.1990 2.9680 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -6.7580 2.8250 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0220 -6.4750 3.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0510 -6.0360 3.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9220 -4.9420 4.2620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1050 -4.4540 4.7900 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1950 -5.1520 4.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7450 -6.5040 3.4370 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -8.9280 3.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 1.8620 2.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1890 1.8810 0.9060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5110 1.8700 0.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8140 -0.1610 0.3690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7980 -2.6220 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -0.1330 1.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0630 -4.6440 0.9160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -5.2800 -0.7060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2160 -6.2520 -1.8810 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0970 -8.4490 -1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0620 -9.6840 0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -4.4720 4.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 -3.5740 5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2000 -4.9210 4.7890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 -9.9850 3.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7070 -8.8180 3.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -8.5260 4.9780 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 7 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 23 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 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 2 0 0 0 0 17 40 1 0 0 0 0 18 19 1 0 0 0 0 18 41 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 22 30 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 2 0 0 0 0 25 29 1 0 0 0 0 26 27 1 0 0 0 0 26 42 1 0 0 0 0 27 28 2 0 0 0 0 27 43 1 0 0 0 0 28 29 1 0 0 0 0 28 44 1 0 0 0 0 30 45 1 0 0 0 0 30 46 1 0 0 0 0 30 47 1 0 0 0 0 M END