IBS-ZINC00489598 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.6180 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6820 -2.0030 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3170 -2.6260 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -1.8690 3.1580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8400 -0.4880 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 0.1390 2.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5870 -2.5500 4.3100 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0010 -2.7510 3.9820 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8440 -3.3630 4.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1980 -3.5620 4.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 -4.1870 5.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3540 -4.2650 4.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5660 -4.7700 5.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6840 -4.6970 4.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6230 -4.1200 3.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4300 -3.6140 2.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2820 -3.6810 3.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9820 -3.2660 3.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6650 -2.8300 2.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7430 -4.0540 2.6460 O 0 0 0 0 0 0 0 0 0 0 0 0 12.9430 -4.5940 3.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4550 -4.5660 6.7160 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1780 -4.3570 6.9530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -3.7680 6.0750 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -2.5950 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3610 -3.7040 2.2000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2920 0.1000 3.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 1.2170 2.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5060 -1.9280 5.2020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1170 -3.5160 4.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3460 -2.4550 3.1250 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6200 -5.2180 6.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6220 -5.0890 5.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3900 -3.1680 1.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1870 -4.0650 4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7990 -5.6530 3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7600 -4.4770 2.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7640 -4.6760 7.8980 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 9 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 9 34 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 26 2 0 0 0 0 12 13 2 0 0 0 0 12 20 1 0 0 0 0 13 14 1 0 0 0 0 13 24 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 22 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 M END