COMGENEX-ZINC04594055 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 57 0 0 1 0 0 0 0 0999 V2000 2.1100 0.6210 0.5680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3580 -0.6580 0.3040 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2610 -1.4950 1.1770 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7950 -0.8720 -0.9010 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1270 -2.1260 -1.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8470 -2.8110 -1.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0170 -1.8440 -2.2580 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 -0.5960 -3.3280 S 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 0.1410 -1.9670 C 0 0 3 0 0 0 0 0 0 0 0 0 0.3350 1.0630 -1.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2100 0.4080 -2.4290 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5540 1.6560 -2.9140 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8470 1.9000 -3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 0.8960 -3.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4510 -0.3520 -2.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 -0.5940 -2.3630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4500 -2.7450 0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 -2.0470 0.8280 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3530 -4.0740 0.2020 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -4.6760 1.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6690 -6.1870 1.3930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2460 -6.8060 2.6400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5550 -7.2510 2.6480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0890 -7.8200 3.7890 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3110 -7.9460 4.9290 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9930 -7.4980 4.9210 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4630 -6.9340 3.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2260 -7.6190 6.0380 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1170 -7.1380 5.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8340 -8.5040 6.0530 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.1940 -8.9400 5.9880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1600 0.4870 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6840 1.4240 -0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0310 0.8780 1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2770 -2.7400 -2.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8920 -1.4220 -1.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 2.4400 -2.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1160 2.8750 -3.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8050 1.0870 -3.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1920 -1.1360 -2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8920 -1.5680 -1.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -4.6320 -0.4570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4320 -4.2430 2.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9850 -4.4820 1.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 -6.6200 0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -6.3810 1.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1620 -7.1530 1.7600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1120 -8.1660 3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -6.5900 3.7620 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6500 -7.6790 5.1750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1090 -6.0740 5.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6170 -7.2950 6.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4850 -9.3660 6.9480 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8370 -8.0920 5.7560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2960 -9.6970 5.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 3 2 0 0 0 0 2 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 17 1 0 0 0 0 7 8 1 0 0 0 0 7 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 41 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 21 46 1 0 0 0 0 22 23 1 0 0 0 0 22 27 2 0 0 0 0 23 24 2 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 25 26 2 0 0 0 0 25 30 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END