IBS-ZINC04664593 MOE2007 3D CORINA 3.40 0006 02.08.2006 40 43 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.7020 1.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0840 1.1880 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7680 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0710 -1.2060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6890 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0610 -4.2750 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.0890 -4.6740 0.9930 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2370 -4.8180 -0.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6340 -5.0780 -2.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5990 -5.0950 -2.1570 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1300 -4.8490 -0.8160 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6250 -6.1400 -0.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -5.8610 1.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0490 -4.7350 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8960 -4.6530 2.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8170 -3.6270 2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9050 -2.6670 1.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0700 -2.7330 0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1400 -3.7710 0.3300 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2580 -3.8520 -0.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4370 -3.1410 -1.8190 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1670 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6290 2.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.6060 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1440 -2.1310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0260 -4.0700 -0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6270 -5.7400 -0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4750 -6.5240 -0.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -6.8780 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5050 -6.7610 1.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1760 -5.5970 1.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8380 -5.3960 3.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4740 -3.5730 3.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6260 -1.8670 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1360 -1.9860 -0.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 28 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 14 34 1 0 0 0 0 15 16 1 0 0 0 0 15 35 1 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 37 1 0 0 0 0 18 19 1 0 0 0 0 18 38 1 0 0 0 0 19 20 2 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 M END