CHEMBRIDGE-ZINC00456645 MOE2007 3D CORINA 3.40 0006 02.08.2006 26 28 0 0 0 0 0 0 0 0999 V2000 -0.0160 1.3580 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2310 -0.6810 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2910 -2.0890 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5180 -2.6830 -0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6750 -1.8940 -0.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6130 -0.5800 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 0.0600 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3790 1.4640 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1690 2.0880 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6260 2.2600 -0.0200 N 0 3 0 0 0 0 0 0 0 0 0 0 3.5720 3.4770 -0.0130 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7070 1.6990 -0.0340 O 0 5 0 0 0 0 0 0 0 0 0 0 4.9240 -2.5170 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1470 -1.8940 -0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0790 -2.8660 -0.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4500 -4.0510 -0.0810 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 -3.8560 -0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.8780 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9240 -0.5600 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3880 -2.6820 -0.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5970 -3.7600 -0.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 3.1680 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3270 -0.8300 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1480 -2.7160 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4060 -4.6300 -0.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 10 2 0 0 0 0 1 19 1 0 0 0 0 2 3 2 0 0 0 0 2 20 1 0 0 0 0 3 4 1 0 0 0 0 3 8 1 0 0 0 0 4 5 2 0 0 0 0 4 21 1 0 0 0 0 5 6 1 0 0 0 0 5 22 1 0 0 0 0 6 7 2 0 0 0 0 6 14 1 0 0 0 0 7 8 1 0 0 0 0 8 9 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 10 23 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 14 15 1 0 0 0 0 14 18 1 0 0 0 0 15 16 2 0 0 0 0 15 24 1 0 0 0 0 16 17 1 0 0 0 0 16 25 1 0 0 0 0 17 18 2 0 0 0 0 18 26 1 0 0 0 0 M CHG 1 11 1 M CHG 1 13 -1 M END