PUBCHEM-ZINC06293272 MOE2007 3D CORINA 3.40 0006 02.08.2006 19 19 0 0 1 0 0 0 0 0999 V2000 -0.0070 1.5540 -0.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 0.0350 0.0470 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.2510 -0.3200 1.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -0.3250 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8550 -1.4550 -0.4540 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2000 0.8110 -0.0280 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4330 1.9210 0.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8120 3.0400 0.5230 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 0.8410 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2240 1.1580 -1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3830 1.4170 -2.4040 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 1.9450 -0.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 1.9820 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0250 1.6050 0.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 -0.1360 0.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4880 1.1220 -1.5640 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.8850 -0.5710 -0.9420 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8550 -0.4730 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -1.5730 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 7 1 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 17 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 9 1 0 0 0 0 7 8 2 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 10 16 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 M CHG 1 16 -1 M END