CHEMBRIDGE-ZINC04987247 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.3240 0.8450 -0.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1650 0.9450 2.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1590 -0.5120 2.6510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5470 -0.9380 3.9120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0890 -0.8210 5.1560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5740 -1.1930 6.3260 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8780 -1.6820 6.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5210 -1.7980 5.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8600 -1.4270 3.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7350 2.9660 1.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7500 3.5680 0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2800 4.2970 -0.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1690 4.9060 -1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5450 4.8050 -1.6240 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0430 4.0910 -0.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1490 3.4770 0.3530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 2.7160 1.4560 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7070 3.1980 2.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 1.6310 1.7310 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.3980 -0.2420 -0.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6950 1.1520 -0.4150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 1.1930 -0.9200 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0510 1.5850 3.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2140 1.0850 2.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2410 -0.6450 2.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -1.1830 1.8360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1070 -0.4430 5.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0730 -1.1040 7.2860 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3920 -1.9750 7.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5370 -2.1810 4.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3780 -1.5250 2.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2830 3.2980 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 3.3120 2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2120 4.4090 -1.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7840 5.4670 -2.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2280 5.2850 -2.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1200 4.0170 -0.4000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6940 1.4470 1.1610 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6750 1.1650 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 23 1 0 0 0 0 2 24 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 25 1 0 0 0 0 3 26 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 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 29 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 10 33 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 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 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 17 1 M CHG 1 19 -1 M CHG 1 38 1 M END