PUBCHEM-ZINC05549550 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 41 0 0 1 0 0 0 0 0999 V2000 0.1850 0.6890 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2170 0.5450 1.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 2.7460 0.7620 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6900 3.0240 0.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 3.4760 -0.3430 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5490 3.5670 -1.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 4.8150 0.1560 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3810 4.7740 1.6090 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4180 4.9840 1.9040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 3.3050 2.0420 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9990 2.7930 2.1410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1800 3.2730 3.0540 O 0 5 0 0 0 0 0 0 0 0 0 0 -0.5790 5.8890 2.0800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7230 6.1620 1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1670 7.2650 2.3110 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 7.7220 3.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 6.8830 2.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1940 7.0370 3.5120 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2190 8.1390 4.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2330 9.0370 4.5160 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 8.8460 3.9010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9730 9.7570 4.1180 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5360 2.9230 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0800 3.6820 -1.7790 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.9820 4.6200 -1.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0510 -0.3960 -0.6230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 0.9540 -0.6150 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3320 1.1300 -1.4590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 0.9520 1.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -0.5290 1.6550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4230 0.6880 2.7320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2940 5.5230 1.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1570 8.3320 4.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8650 9.6160 3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7970 10.5400 4.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4960 1.8820 -1.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2390 3.0010 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4290 1.2170 0.6660 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4140 0.9340 0.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 38 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 2 31 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 10 1 0 0 0 0 3 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 23 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 33 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 34 1 0 0 0 0 22 35 1 0 0 0 0 23 24 1 0 0 0 0 23 36 1 0 0 0 0 23 37 1 0 0 0 0 24 25 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 12 -1 M CHG 1 38 1 M END