IBS-ZINC05164074 MOE2007 3D CORINA 3.40 0006 02.08.2006 45 48 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 1.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2070 0.1470 2.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -0.4580 3.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9000 -1.8500 3.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3160 -2.6300 2.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6730 -1.9990 1.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5190 -3.9620 2.4610 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2130 -4.7080 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2210 -4.0770 3.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 -2.7900 4.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1590 -2.6510 5.2760 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5700 -3.7080 5.9430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3420 -4.9380 5.5220 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6800 -5.1690 4.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4470 -6.4670 3.9620 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0180 -7.4430 4.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 -8.8590 4.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6270 -8.0900 2.1390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9730 -6.6740 2.6060 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9500 -10.4410 2.6210 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 -10.6940 1.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1250 -10.6280 1.5830 O 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 1.1600 1.2250 1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 0.1420 3.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 -2.5870 0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1130 -3.5640 6.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1010 -7.3260 4.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6030 -7.2770 5.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -9.5850 5.1120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5880 -8.9850 4.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5440 -8.2070 2.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -8.2560 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5260 -5.9480 1.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0560 -6.5480 2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8840 -10.5790 2.4430 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2850 -11.1420 3.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4690 -11.6820 0.9380 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -9.9370 0.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6760 -10.7800 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1970 -9.0660 3.0770 N 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 12 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 1 0 0 0 0 9 11 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 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 45 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 22 45 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 23 43 1 0 0 0 0 24 44 1 0 0 0 0 M END