NCID-ZINC01644058 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 23 0 0 0 0 0 0 0 0999 V2000 -0.0130 1.0860 0.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 1.0700 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7560 1.5750 2.5120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6770 2.6020 2.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 3.0660 3.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9900 2.5040 4.8090 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0710 1.4760 4.8910 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4550 1.0050 3.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 4.1670 3.4980 N 0 3 0 0 0 0 0 0 0 0 0 0 -5.5470 4.6630 2.4180 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8230 4.5760 4.5080 O 0 5 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0100 1.4630 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.4470 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0840 -0.0200 1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6260 1.4300 0.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9150 3.0430 1.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4730 2.8680 5.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 1.0380 5.8490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 1.5600 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1950 1.2920 2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5540 -0.0100 3.8170 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6420 0.2830 3.9520 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 13 1 0 0 0 0 1 14 1 0 0 0 0 1 20 1 0 0 0 0 2 3 1 0 0 0 0 2 15 1 0 0 0 0 2 16 1 0 0 0 0 2 20 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 17 1 0 0 0 0 5 6 1 0 0 0 0 5 9 1 0 0 0 0 6 7 2 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 19 1 0 0 0 0 8 22 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 M CHG 1 9 1 M CHG 1 11 -1 M END