PUBCHEM-ZINC05133444 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 0 0 0 0 0 0999 V2000 -0.0830 2.4070 2.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1100 0.9490 1.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1260 0.1870 2.0920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4110 0.8930 1.6390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4380 2.3570 2.0790 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1950 3.1160 1.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3140 4.5740 2.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 4.9500 2.9470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1500 -1.1800 1.5740 N 0 0 0 0 0 0 0 0 0 0 0 0 0.7270 -2.5110 2.4720 P 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 -4.1540 1.3940 S 0 0 0 0 0 0 0 0 0 0 0 0 1.6580 -2.3560 3.8420 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0840 -2.6430 3.8070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -3.5050 4.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7900 -2.1230 3.0300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -3.1430 3.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -2.3870 2.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9610 2.9290 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1720 2.4380 3.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0270 0.4790 1.9650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1610 0.9200 0.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1140 0.1770 3.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2880 0.3790 2.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 0.8500 0.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5070 2.4060 3.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3500 2.8260 1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2000 3.1450 0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7920 -1.2000 0.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 -3.0270 2.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7130 -1.9470 4.3470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1180 -3.3950 5.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9070 -4.4980 4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4000 -4.1810 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2600 -2.8820 4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7440 -1.6120 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8860 -2.8990 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2470 5.2360 1.5460 O 0 5 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 18 1 0 0 0 0 1 19 1 0 0 0 0 2 3 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 4 1 0 0 0 0 3 9 1 0 0 0 0 3 22 1 0 0 0 0 4 5 1 0 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 7 8 2 0 0 0 0 7 37 1 0 0 0 0 9 10 1 0 0 0 0 9 28 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 13 14 1 0 0 0 0 13 29 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 14 32 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 17 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 M CHG 1 37 -1 M END