CHEMDIV-ZINC00215774 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 0 0 0 0 0 0999 V2000 2.0430 1.8600 0.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6680 0.4120 -0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8750 -0.3190 1.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5870 -1.6560 1.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7970 -2.3240 2.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -3.6950 2.3160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0660 -4.4380 1.2230 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 -3.7520 0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 -2.3760 -0.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -5.8100 1.3980 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 -6.7750 0.5690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3510 -8.1150 0.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2360 -9.1280 0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9960 -8.7500 -1.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6790 -9.6480 -1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 -9.1970 -2.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -7.8380 -3.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8190 -6.9420 -2.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0860 -7.3670 -1.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5040 -6.4200 -0.5240 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0200 -10.5590 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1020 -11.4480 -0.3300 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0880 1.9370 0.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 2.4670 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4320 2.2780 0.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6150 0.3640 -0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 0.0160 -0.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1630 -1.7760 3.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7110 -4.1790 3.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5020 -4.2790 -0.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -1.9070 -1.0560 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1020 -6.1800 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9290 -8.3990 1.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6460 -10.7200 -1.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9190 -9.9090 -3.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -7.4710 -4.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8830 -5.8760 -2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0500 -10.7570 1.8220 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 28 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 32 1 0 0 0 0 11 12 1 0 0 0 0 11 20 2 0 0 0 0 12 13 2 0 0 0 0 12 33 1 0 0 0 0 13 14 1 0 0 0 0 13 21 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 34 1 0 0 0 0 16 17 1 0 0 0 0 16 35 1 0 0 0 0 17 18 2 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 37 1 0 0 0 0 19 20 1 0 0 0 0 21 22 1 0 0 0 0 21 38 2 0 0 0 0 M CHG 1 22 -1 M END