IBS-ZINC04085449 MOE2007 3D CORINA 3.40 0006 02.08.2006 54 57 0 0 1 0 0 0 0 0999 V2000 1.3450 -0.6690 -0.2650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.0170 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 1.3200 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 1.9060 0.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4120 3.1060 0.6440 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4680 1.1750 0.4660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4460 -0.1580 0.2560 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2220 -0.8080 0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -2.1890 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3590 -2.9020 -0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 -2.2640 0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 -0.8990 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 -2.9870 0.0560 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.9450 -2.2590 0.1890 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8600 -1.3060 -0.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2290 -2.0050 1.6710 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0740 -3.0600 -0.4080 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8700 -4.1830 -0.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3100 -2.5270 -0.4870 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.4060 -3.3050 -1.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.6920 -2.4760 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.8200 -3.2760 -1.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.2440 -3.2330 -2.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.2890 -4.0990 -3.0830 N 0 0 0 0 0 0 0 0 0 0 0 0 -13.7600 -4.2420 -3.9180 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.5700 -4.7370 -1.8960 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.6590 -4.2540 -0.9380 C 0 0 0 0 0 0 0 0 0 0 0 0 -12.7050 -4.7340 0.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 -13.6350 -5.6750 0.7170 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5340 -6.1570 -0.2250 C 0 0 0 0 0 0 0 0 0 0 0 0 -14.5100 -5.6910 -1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1580 2.1750 0.2000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 0.0870 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5370 -1.4190 0.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3330 -1.1470 -1.2440 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2560 -2.6890 -0.4060 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3380 -3.9680 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5640 -0.4110 0.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4120 -1.4260 2.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1610 -1.4500 1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3140 -2.9580 2.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4720 -1.6290 -0.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1640 -3.5620 -2.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5500 -4.2180 -0.4900 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9340 -2.2190 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.5480 -1.5630 -1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8220 -2.6060 -3.6810 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0090 -4.3640 1.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -13.6700 -6.0460 1.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2620 -6.9000 0.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 -15.2130 -6.0740 -2.2470 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 2.5380 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 3.0230 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0110 1.5830 0.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 2 0 0 0 0 2 8 1 0 0 0 0 3 4 1 0 0 0 0 3 32 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 17 1 0 0 0 0 16 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 2 0 0 0 0 22 27 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 30 2 0 0 0 0 29 49 1 0 0 0 0 30 31 1 0 0 0 0 30 50 1 0 0 0 0 31 51 1 0 0 0 0 32 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 M END