PUBCHEM-ZINC06444454 MOE2007 3D CORINA 3.40 0006 02.08.2006 24 25 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3880 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 1.2190 -0.6840 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 0.0280 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3890 1.4140 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1760 2.0940 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1600 3.5740 0.0100 N 0 3 0 0 0 0 0 0 0 0 0 0 1.1620 4.1780 1.0680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 4.1880 -1.0420 O 0 5 0 0 0 0 0 0 0 0 0 0 3.7040 -0.6930 -0.0370 N 0 3 0 0 0 0 0 0 0 0 0 0 4.2260 -0.9840 -1.0980 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -0.9950 1.0120 O 0 5 0 0 0 0 0 0 0 0 0 0 0.9210 -2.0450 -0.0170 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5680 -2.7670 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4180 -2.1880 -0.0040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0090 -3.2520 -0.0030 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0030 -0.9750 0.0070 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9580 -0.8050 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2360 2.0730 0.0190 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 1.6580 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0710 1.5780 0.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2480 3.0430 0.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5900 2.1310 -0.0220 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5760 3.1010 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 17 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 10 1 0 0 0 0 5 6 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 19 21 1 0 0 0 0 19 22 1 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M CHG 1 10 1 M CHG 1 12 -1 M END