CHEMBRIDGE-ZINC03912512 MOE2007 3D CORINA 3.40 0006 02.08.2006 29 29 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 0.7420 -0.5110 1.2420 C 0 0 3 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 0.8720 -2.0340 1.1710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 -2.6150 1.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.1400 2.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 0.6490 -0.0070 3.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 0.3440 4.8060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6510 0.4650 5.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9640 0.2410 5.9990 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5930 -0.0910 4.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9600 -0.2200 3.7420 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0030 0.8130 7.1710 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 0.5850 4.7590 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.2890 -0.3360 4.9460 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9400 1.7040 4.5340 O 0 5 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -2.3060 0.3260 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3190 -2.4040 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -3.5800 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9650 0.0130 2.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6590 -0.2650 4.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 0.9750 7.1620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 0.8950 7.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 18 1 0 0 0 0 1 19 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 21 1 0 0 0 0 2 22 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 25 1 0 0 0 0 7 8 1 0 0 0 0 7 26 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 14 1 0 0 0 0 11 12 2 0 0 0 0 12 13 1 0 0 0 0 12 27 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 M CHG 1 15 1 M CHG 1 17 -1 M END