PUBCHEM-ZINC04773679 MOE2007 3D CORINA 3.40 0006 02.08.2006 37 39 0 0 1 0 0 0 0 0999 V2000 0.1620 1.3390 -0.3470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 -0.4180 0.0720 S 0 3 0 0 0 0 0 0 0 0 0 0 0.1870 -0.2360 1.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -0.4860 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1900 -1.9430 0.1940 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.8470 -2.2820 1.1780 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6620 -2.2690 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.2840 -1.3800 -0.1740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6890 -3.2150 -1.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.7770 -2.5460 -2.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 -3.7390 -1.2940 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9410 -3.9000 -2.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4190 -2.6420 -0.8040 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8510 -4.9380 -0.5730 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.5740 -6.1650 -1.1130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1970 -6.9270 -0.0230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8160 -8.2500 -0.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8450 -8.6950 -1.5490 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2400 -7.8410 -2.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6090 -6.5530 -2.4000 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4030 -9.1150 0.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2610 -6.1720 1.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -4.9520 0.7720 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 -4.1750 -1.0380 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.1820 -2.9490 1.1240 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6200 -3.7180 0.6700 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1920 1.6610 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0710 1.4870 -1.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5100 1.9610 0.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 0.5270 2.2720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -1.1880 2.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2180 0.0480 2.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2910 0.1460 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1470 -0.1300 -0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2570 -8.2490 -3.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3730 -8.8280 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1380 -10.0480 0.4440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 13 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 25 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 24 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 19 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 22 23 2 0 0 0 0 25 26 1 0 0 0 0 M CHG 1 2 1 M CHG 1 24 -1 M END