CHEMDIV-ZINC01181215 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 45 0 0 0 0 0 0 0 0999 V2000 -0.1260 1.1390 -0.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7580 0.2000 0.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1730 -0.4680 1.3990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7520 0.1990 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6340 -0.4760 3.3180 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9270 -1.8220 3.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -2.5110 2.0180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4480 -1.8260 1.1670 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1900 -2.5020 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2860 -1.9310 -1.0740 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -3.7810 0.2380 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -4.5580 -0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8250 -4.1640 -0.8990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5820 -5.0460 -1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2840 -6.1710 -1.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9930 -6.9850 -2.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0000 -6.6730 -3.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -5.5710 -4.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5870 -4.7610 -3.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9100 -7.7390 -4.8000 S 0 0 0 0 0 0 0 0 0 0 0 0 -5.1630 -7.5830 -6.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.7840 -9.0550 -4.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3950 -7.1680 -4.8480 N 0 5 0 0 0 0 0 0 0 0 0 0 -7.3240 -6.2480 -5.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 -3.8350 1.7450 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5880 -4.4990 2.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7190 0.6940 -0.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8660 1.4610 -0.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2020 2.0230 0.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5040 1.2370 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0870 0.0420 4.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6130 -2.3080 3.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4900 -4.2030 1.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8360 -4.4240 -1.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2550 -5.6110 -0.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3050 -4.2070 0.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9140 -3.1170 -1.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2880 -6.4180 -0.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5350 -7.8510 -1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2940 -5.3400 -5.1940 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -3.9000 -3.6210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -3.9980 2.3810 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3040 -4.5900 3.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6890 -5.5110 2.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 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 30 1 0 0 0 0 5 6 1 0 0 0 0 5 31 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 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 20 1 0 0 0 0 18 19 1 0 0 0 0 18 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 25 26 1 0 0 0 0 26 42 1 0 0 0 0 26 43 1 0 0 0 0 26 44 1 0 0 0 0 M CHG 1 23 -1 M END