IBS-ZINC04994773 MOE2007 3D CORINA 3.40 0006 02.08.2006 36 38 0 0 0 0 0 0 0 0999 V2000 -5.0790 -3.0040 2.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -3.3190 1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5960 -3.2190 2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3500 -3.5060 1.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2280 -3.8980 0.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3610 -3.9980 -0.2780 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6040 -3.7130 0.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0310 -4.1890 -0.0100 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -4.9100 -1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2870 -4.2500 -2.4000 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -4.9580 -3.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -6.3190 -3.6080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -7.0280 -2.4050 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0950 -6.3220 -1.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 -6.9930 -0.0360 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.0830 -8.3030 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0190 -9.0590 -1.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -8.4350 -2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -7.0500 -4.8900 N 0 3 0 0 0 0 0 0 0 0 0 0 1.2100 -6.6400 -5.7620 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1880 -8.0630 -5.0740 O 0 5 0 0 0 0 0 0 0 0 0 0 0.3360 -2.7710 -2.4200 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3700 -2.1770 -3.4830 O 0 0 0 0 0 0 0 0 0 0 0 0 0.3420 -2.1480 -1.3730 O 0 5 0 0 0 0 0 0 0 0 0 0 -5.2970 -1.9450 2.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8360 -3.6010 1.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0880 -3.2380 3.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6920 -2.9140 3.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -3.4270 2.4720 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2690 -4.3020 -1.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -3.7950 -0.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 -3.8900 0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5100 -4.4190 -4.5220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1960 -8.8100 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0160 -10.1370 -1.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2300 -9.0050 -3.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 28 1 0 0 0 0 4 5 1 0 0 0 0 4 29 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 2 0 0 0 0 9 14 1 0 0 0 0 10 11 1 0 0 0 0 10 22 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 19 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 15 16 1 0 0 0 0 16 17 2 0 0 0 0 16 34 1 0 0 0 0 17 18 1 0 0 0 0 17 35 1 0 0 0 0 18 36 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 22 1 M CHG 1 24 -1 M END