CHEMBRIDGE-ZINC00471392 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 40 0 0 1 0 0 0 0 0999 V2000 0.1210 1.3490 0.6870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -0.0120 -0.0020 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2510 0.0930 -1.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9600 -0.9840 0.6410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9520 -1.5800 -0.1140 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8280 -2.4720 0.4770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7120 -2.7680 1.8220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7190 -2.1710 2.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -1.2760 1.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 -3.7230 2.4540 N 0 3 0 0 0 0 0 0 0 0 0 0 4.5230 -4.2490 1.7880 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5460 -3.9830 3.6390 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.4050 -0.5260 0.1360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7280 -1.1500 1.1250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3070 -0.2930 -0.8380 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.0120 0.3620 -2.1150 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3510 0.3920 -2.8710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3330 -0.2710 -1.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6580 -0.6450 -0.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3630 -1.2870 0.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7100 -1.5460 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3730 -1.1730 -1.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6840 -0.5280 -2.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1470 1.7100 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5520 2.0580 0.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1480 1.2480 1.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0430 -1.3500 -1.1650 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6030 -2.9390 -0.1130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 -2.4020 3.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0740 -0.8060 2.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6510 1.3770 -1.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 -0.2130 -2.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6510 1.4200 -3.0720 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2740 -0.1710 -3.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8510 -1.5820 1.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2490 -2.0430 0.8910 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4270 -1.3780 -1.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2000 -0.2370 -2.9700 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 13 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 27 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 10 1 0 0 0 0 8 9 1 0 0 0 0 8 29 1 0 0 0 0 9 30 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 19 1 0 0 0 0 16 17 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 33 1 0 0 0 0 17 34 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 21 22 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 M CHG 1 10 1 M CHG 1 12 -1 M END