CHEMBRIDGE-ZINC04423750 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2000 -0.6370 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3730 0.1060 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5950 -0.5300 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -1.9290 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4710 -2.6770 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -2.0310 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -2.7530 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2270 -4.1770 -0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9560 -2.6100 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0980 -1.8870 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3930 -2.5640 0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4430 -3.7810 0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.6400 -1.7740 0.0750 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5870 -0.3780 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7540 0.3540 0.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.9820 -0.2880 0.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.0490 -1.6670 0.0990 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.8840 -2.4200 0.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6960 1.8330 0.1050 N 0 3 0 0 0 0 0 0 0 0 0 0 -8.6180 2.4010 0.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.7260 2.4830 0.1190 O 0 5 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3280 1.1840 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5060 0.0500 0.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5120 -3.7560 0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7640 -4.6300 -0.0510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7610 -4.5010 0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7810 -4.4840 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0010 -3.6900 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0540 -0.8080 0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6320 0.1270 0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.8920 0.2940 0.1180 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.0090 -2.1610 0.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9480 -3.7750 0.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9600 -4.1760 0.9440 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 28 1 0 0 0 0 6 7 2 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 32 1 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 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 20 2 0 0 0 0 16 17 2 0 0 0 0 16 35 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 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 38 39 1 0 0 0 0 M CHG 1 21 1 M CHG 1 23 -1 M END