IBS-ZINC02450098 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0420 -0.1240 2.4970 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2110 0.9530 2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 -0.5140 3.7210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 0.3330 4.7280 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8810 1.2780 4.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -0.4010 5.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4060 -0.1010 6.8700 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0560 -1.0920 7.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1100 -2.3870 7.0770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5220 -2.7010 5.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8580 -1.7120 5.1540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1890 -1.7110 3.9720 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3300 -0.8210 2.5030 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3820 -0.2980 1.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 0.7530 1.2410 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6700 -0.9950 1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7220 -0.4720 1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0170 -1.1720 1.1930 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1110 -0.6330 0.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.3200 -1.2960 0.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4530 -2.4910 1.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3750 -3.0300 1.8830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1580 -2.3830 1.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8350 -1.5960 1.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7350 -0.0630 1.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3670 0.9050 7.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5260 -0.8600 8.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -3.1540 7.6390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5710 -3.7120 5.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4260 -1.6580 2.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7770 -1.9270 2.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 0.4610 0.6530 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0080 0.3000 -0.0260 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1660 -0.8800 -0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.4030 -3.0050 1.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4870 -3.9640 2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3160 -2.8080 2.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 31 1 0 0 0 0 3 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 4 5 1 0 0 0 0 4 35 1 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 7 16 2 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 37 1 0 0 0 0 12 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 17 18 1 0 0 0 0 17 41 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 2 0 0 0 0 20 42 1 0 0 0 0 21 22 1 0 0 0 0 21 43 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 26 2 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 27 48 1 0 0 0 0 M END