CHEMDIV-ZINC04652862 MOE2007 3D CORINA 3.40 0006 02.08.2006 41 43 0 0 0 0 0 0 0 0999 V2000 0.1030 1.5780 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1040 0.0560 -0.2990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8220 -0.3800 0.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.8970 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6060 -2.3880 1.0960 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -2.0100 -0.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3290 -0.4950 -0.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0920 -3.1770 2.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -3.3610 3.1730 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4980 -3.7490 1.9810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8030 -4.8550 2.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3860 -4.7050 4.2540 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8090 -3.5920 5.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 -3.8010 6.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4790 -5.0830 6.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0650 -6.2010 6.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5240 -5.9800 4.8130 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0370 -6.8740 3.8920 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.9870 -7.8810 3.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6040 -6.2120 2.7790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0310 -6.9380 1.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5980 -6.2830 0.6660 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.8670 -2.4440 7.2160 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.1270 1.9660 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3880 1.8860 -1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4250 2.0510 0.4040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6450 -0.3590 -1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 -0.0510 0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 0.0960 1.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3240 -2.3880 0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2560 -2.1770 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8790 -2.5190 -0.9550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3910 -2.3360 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9140 -0.0170 0.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8180 -0.2490 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2070 -2.9250 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6470 -4.1140 0.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7070 -2.5890 4.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9010 -5.2260 7.8070 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 -7.2020 6.4940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0170 -8.2040 1.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 34 1 0 0 0 0 7 35 1 0 0 0 0 8 9 2 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 2 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 41 2 0 0 0 0 M CHG 1 22 -1 M END