CHEMDIV-ZINC05184973 MOE2007 3D CORINA 3.40 0006 02.08.2006 27 27 0 0 1 0 0 0 0 0999 V2000 -0.0900 1.6190 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0820 0.0980 -0.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -0.5120 0.0130 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.1100 -0.0790 -0.7830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4460 -2.0240 -0.2130 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1360 -0.1920 1.2880 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4130 0.5280 1.3400 C 0 0 3 0 0 0 0 0 0 0 0 0 -3.3580 1.3870 0.6600 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4400 1.0300 2.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6720 -0.0300 3.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6750 -0.5430 2.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6660 -1.1720 2.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6400 -0.3370 0.9390 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2790 -0.8780 1.8860 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9220 2.0090 -0.1710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7370 2.0500 -0.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4390 1.9660 0.9570 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3580 -0.1930 -1.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 -0.2970 0.6780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8080 -2.5260 0.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -2.4590 -0.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -2.2560 -1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 1.9830 2.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4450 1.1970 3.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1640 0.3980 4.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3160 -0.8560 3.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8580 -0.3930 -0.3070 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 1 17 1 0 0 0 0 2 3 1 0 0 0 0 2 18 1 0 0 0 0 2 19 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 6 1 0 0 0 0 5 20 1 0 0 0 0 5 21 1 0 0 0 0 5 22 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 9 10 1 0 0 0 0 9 23 1 0 0 0 0 9 24 1 0 0 0 0 10 11 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 12 2 0 0 0 0 13 14 2 0 0 0 0 13 27 1 0 0 0 0 M CHG 1 27 -1 M END