PUBCHEM-ZINC04772503 MOE2007 3D CORINA 3.40 0006 02.08.2006 31 33 0 0 1 0 0 0 0 0999 V2000 0.0780 1.3390 -0.4690 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 0.0390 -0.6790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 -0.3800 -0.4300 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1490 0.6830 -0.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3300 1.7850 -0.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7030 3.1640 0.1350 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7170 3.2960 -0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6650 3.6420 1.6060 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6420 3.4080 2.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 5.1630 1.3760 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6000 5.5770 1.2740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8370 5.3360 0.0510 C 0 0 3 0 0 0 0 0 0 0 0 0 1.3670 6.0550 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 4.0670 -0.6520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 5.7680 0.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 5.9880 -1.1370 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9210 5.1920 -1.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9580 5.7940 2.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4980 5.0020 2.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5620 3.2850 2.2640 O 0 5 0 0 0 0 0 0 0 0 0 0 3.5410 0.5520 0.2200 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2950 1.4790 0.5000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0030 -0.7590 0.1690 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9790 -0.9310 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1880 -1.8590 -0.1720 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6050 -2.7840 -0.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8370 -1.7410 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -2.7230 -0.7860 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.7690 2.0100 -0.5410 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2390 4.9990 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7230 6.7050 0.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 5 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 3 4 2 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 14 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 20 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 18 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 15 16 1 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 16 17 1 0 0 0 0 18 19 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 27 28 2 0 0 0 0 M CHG 1 20 -1 M END