COMGENEX-ZINC04717371 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 -5.4220 0.5360 -2.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 1.1550 -1.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1420 0.3230 -0.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6920 -0.9570 -0.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0380 -1.7120 0.3610 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7750 -1.1850 1.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2030 0.1050 1.9420 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8850 0.8540 0.9790 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8990 0.5140 3.2130 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3470 1.8070 3.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5720 -3.0750 0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3600 -3.2360 -0.0620 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5090 -4.0980 -0.0030 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9660 -3.9710 0.2750 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.1010 -3.1760 1.0190 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4330 -5.2840 0.8930 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4550 -6.5710 0.0800 S 0 0 0 0 0 0 0 0 0 0 0 0 -3.0580 -5.4570 -0.2830 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2890 -5.6830 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4800 -5.6960 -1.6660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1420 -6.1100 -1.7960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5830 -6.3600 -3.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3510 -6.1950 -4.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6750 -5.7800 -4.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2340 -5.5330 -2.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9070 -3.5710 -0.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3580 -3.2300 -1.9770 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 1.2820 -2.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6580 0.2280 -2.9970 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0600 -0.3050 -1.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8390 -1.3860 -1.5970 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2420 -1.7760 2.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2410 1.8580 1.1870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0400 1.9740 4.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 2.5850 2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4400 1.8750 3.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1830 -5.3080 1.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5000 -5.4960 0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5200 -6.2340 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4530 -6.6770 -3.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9170 -6.3860 -5.1790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2790 -5.6430 -4.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 -5.2120 -2.7850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1400 -3.5890 -0.6090 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 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 31 1 0 0 0 0 5 6 1 0 0 0 0 5 11 1 0 0 0 0 6 7 2 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 26 1 0 0 0 0 16 17 1 0 0 0 0 16 37 1 0 0 0 0 16 38 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 24 2 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 25 43 1 0 0 0 0 26 27 2 0 0 0 0 26 44 1 0 0 0 0 M CHG 1 44 -1 M END