IBS-ZINC06661987 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 0 0 0 0 0 0999 V2000 -0.0530 1.5400 -0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 0.0110 -0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3920 -0.5060 0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0220 -0.7380 -1.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4650 -0.5220 -2.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3980 -1.2580 -1.1310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -1.5210 -2.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4010 -2.0090 -2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9860 -2.2370 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2820 -1.9770 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9880 -1.4880 0.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 -1.2150 1.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9940 -0.7460 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3790 -0.5250 2.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8450 -1.4470 2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5470 -2.8550 3.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9020 -3.5930 2.3200 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9980 -3.2950 4.2260 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8220 -4.6350 4.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6790 -5.6090 3.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5050 -6.9300 3.9710 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4750 -7.2840 5.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6180 -6.3170 6.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7850 -4.9930 5.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9340 -3.9380 6.9970 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2540 -2.7160 -0.8940 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7950 -2.9270 0.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1040 -2.2680 -3.3500 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.4460 -2.0120 -4.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9670 1.9250 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5820 1.8950 -0.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5660 1.8910 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4920 -0.3400 -0.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -0.3440 0.8760 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6610 -1.3450 -3.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7400 -2.1560 1.1590 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4230 -0.7420 3.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9240 -1.3040 2.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4440 -2.6830 4.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7030 -5.3330 2.5650 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3940 -7.6880 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3390 -8.3180 5.5880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5940 -6.5970 7.3280 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9880 -3.8200 7.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3820 -4.2420 7.8870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5380 -2.9920 6.6290 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1780 -3.6490 0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8070 -1.9840 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8120 -3.3110 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5460 -2.6230 -4.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1160 -2.2600 -5.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1760 -0.9580 -4.6500 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 1 0 0 0 0 3 13 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 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 35 1 0 0 0 0 8 9 1 0 0 0 0 8 28 1 0 0 0 0 9 10 2 0 0 0 0 9 26 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 12 13 1 0 0 0 0 12 15 1 0 0 0 0 13 14 2 0 0 0 0 15 16 1 0 0 0 0 15 37 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 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 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 42 1 0 0 0 0 23 24 1 0 0 0 0 23 43 1 0 0 0 0 24 25 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 M END