CHEMBRIDGE-ZINC04646783 MOE2007 3D CORINA 3.40 0006 02.08.2006 57 58 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5340 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4860 -0.4250 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2320 0.7920 0.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4530 1.9950 -0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6920 0.8150 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4320 1.9520 0.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8690 1.9740 0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2620 1.1600 -0.4280 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7170 2.8990 0.8730 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1140 2.9200 0.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8540 4.0580 1.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3130 4.0800 0.6800 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0210 5.1700 1.3560 N 0 0 0 0 0 0 0 0 0 0 0 0 12.3280 5.3820 1.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9180 4.6710 0.3180 O 0 0 0 0 0 0 0 0 0 0 0 0 13.0570 6.5030 1.8000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.5160 6.5250 1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 15.2560 7.6630 2.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6960 7.7860 1.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 17.5880 8.1350 2.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 16.6580 8.2110 3.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 15.4390 7.3390 3.5500 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5330 1.9060 -0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5160 1.8960 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 -0.3890 0.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5020 -0.3790 -0.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6390 -1.3090 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -0.6100 -1.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1690 0.7860 1.6750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7810 2.2010 -1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5820 2.8770 0.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 -0.1350 0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7300 0.9700 -0.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9580 2.9030 0.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3930 1.7970 1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4020 3.5500 1.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5870 1.9700 0.6800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1530 3.0760 -0.6450 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3800 5.0080 0.8920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8150 3.9030 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7860 3.1300 0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3520 4.2360 -0.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5500 5.7380 1.9850 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5840 7.4530 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0180 6.3470 2.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9900 5.5750 1.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5550 6.6800 0.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 14.7190 8.6030 1.9190 H 0 0 0 0 0 0 0 0 0 0 0 0 17.0140 6.8400 1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 16.7500 8.5800 0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 18.3380 7.3580 2.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 18.0730 9.0980 2.5520 H 0 0 0 0 0 0 0 0 0 0 0 0 17.1540 7.8010 4.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 16.3480 9.2410 4.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5560 7.6320 4.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6590 6.2810 3.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 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 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 30 1 0 0 0 0 5 31 1 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 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 37 1 0 0 0 0 11 12 1 0 0 0 0 11 38 1 0 0 0 0 11 39 1 0 0 0 0 12 13 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 44 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 23 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 22 1 0 0 0 0 21 52 1 0 0 0 0 21 53 1 0 0 0 0 22 23 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 23 56 1 0 0 0 0 23 57 1 0 0 0 0 M END