PUBCHEM-ZINC05131903 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 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 3 0 0 0 0 0 0 0 0 0 0.4320 -0.3560 -0.9350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4050 -0.5260 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8070 -0.9100 1.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 2.0330 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0980 2.3160 -1.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 2.1950 -2.2450 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3020 2.7570 -0.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0280 3.0300 -1.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 2.7580 0.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2820 3.1000 1.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1470 2.3210 1.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8870 2.2230 2.0520 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 1.7770 -0.2060 1.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2120 -0.5650 -0.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8140 -0.4890 1.1260 N 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -0.1750 2.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1060 -0.9080 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 19 1 0 0 0 0 4 5 2 0 0 0 0 4 18 1 0 0 0 0 6 7 1 0 0 0 0 6 13 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 17 19 1 0 0 0 0 18 21 1 0 0 0 0 19 20 1 0 0 0 0 M END