CHEMBRIDGE-ZINC03878514 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.9780 1.5060 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 0.0080 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5400 -0.7630 0.8860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3960 -2.1360 0.8890 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5240 -2.7440 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2000 -1.9670 -0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0550 -0.5930 -0.8950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8440 0.2510 -1.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3760 -4.1340 -0.0060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 -4.8440 1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -6.2350 1.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 -6.9010 2.3900 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7400 -6.1880 3.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7690 -4.8720 3.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6570 -4.2050 2.3370 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5600 -8.2880 2.4400 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -8.9430 3.6740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0240 -8.3600 4.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0040 -9.0110 5.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6160 -10.2420 6.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2160 -10.8250 5.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 -10.1820 3.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -12.1670 5.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -10.9490 7.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2930 -6.9870 -0.0890 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2710 -7.3230 -0.7340 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8230 -7.2700 -0.4840 O 0 5 0 0 0 0 0 0 0 0 0 0 1.7770 1.7860 -0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0450 1.9710 -0.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2260 1.8450 0.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2180 -0.2900 1.5810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -2.7380 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8780 -2.4360 -1.5990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2770 0.3740 -2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7930 -0.2380 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0340 1.2290 -1.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 -4.6010 -0.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8920 -4.3230 4.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 -8.8020 1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5070 -7.3980 4.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -8.5580 6.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6610 -10.6400 2.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1680 -12.9580 4.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -12.2330 4.4360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2780 -12.2800 6.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2440 -11.5870 7.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5360 -11.5600 7.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -10.2120 8.2510 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 32 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 8 34 1 0 0 0 0 8 35 1 0 0 0 0 8 36 1 0 0 0 0 9 10 1 0 0 0 0 9 37 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 25 1 0 0 0 0 12 13 1 0 0 0 0 12 16 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 16 17 1 0 0 0 0 16 39 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 40 1 0 0 0 0 19 20 1 0 0 0 0 19 41 1 0 0 0 0 20 21 2 0 0 0 0 20 24 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 22 42 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 27 1 0 0 0 0 M CHG 1 25 1 M CHG 1 27 -1 M END