PUBCHEM-ZINC06442656 MOE2007 3D CORINA 3.40 0006 02.08.2006 21 21 0 0 1 0 0 0 0 0999 V2000 -0.0210 1.4910 -0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0340 -0.0270 -0.1950 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2990 -0.4040 -1.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4970 -0.4980 0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 -1.0950 1.1870 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -0.5980 0.8840 N 0 0 0 0 0 0 0 0 0 0 0 0 2.1340 -0.6330 0.9780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -1.2680 2.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0400 -1.3000 2.2640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7900 -0.7670 1.2620 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2460 -0.1790 0.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0010 0.2810 -0.7130 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8790 -0.1320 0.0320 N 0 0 0 0 0 0 0 0 0 0 0 0 5.8000 -0.7850 1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9900 1.8860 -0.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6540 1.9190 -0.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 1.8630 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 -1.0160 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0600 -1.6730 2.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5710 -1.7390 3.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3350 -0.2440 -0.8380 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 6 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 13 2 0 0 0 0 8 9 2 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 20 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 11 13 1 0 0 0 0 M CHG 1 21 -1 M END