CHEMDIV-ZINC00031648 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 41 0 0 0 0 0 0 0 0999 V2000 -0.3180 1.3950 -1.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5470 0.0010 -1.1840 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5010 -0.5760 -0.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2630 0.0740 0.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2140 -0.6370 1.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4050 -2.0020 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6340 -2.6620 0.1380 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6940 -1.9440 -0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7980 -4.1070 -0.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5870 -4.5300 -1.2760 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1660 -4.9070 0.9210 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3840 -6.3410 0.7690 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7590 -6.6620 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0360 -8.1470 0.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7950 -8.7730 1.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0660 -10.1430 1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5740 -10.8930 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8010 -10.2950 -1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5350 -8.9240 -0.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9140 -12.6740 -0.0790 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.7620 -13.1960 -0.8100 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9530 -13.0410 1.3340 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.3020 -12.8280 -0.8420 N 0 5 0 0 0 0 0 0 0 0 0 0 -7.1480 -12.4840 -1.7690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4620 1.6960 -1.7150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2180 1.9740 -1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 1.6120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1480 1.1330 0.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8150 -0.1210 2.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1750 -2.5190 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1010 -2.4490 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2780 -4.5150 1.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5860 -6.7500 0.1370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 -6.7840 1.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5410 -6.1670 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8480 -6.2390 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1890 -8.1960 1.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6580 -10.6180 1.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 -10.8870 -1.8330 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9390 -8.4600 -1.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 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 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 6 7 2 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 31 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 32 1 0 0 0 0 12 13 1 0 0 0 0 12 33 1 0 0 0 0 12 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 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 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 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 39 1 0 0 0 0 19 40 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 M CHG 1 23 -1 M END