COMGENEX-ZINC04955581 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 43 0 0 0 0 0 0 0 0999 V2000 -0.0190 1.5260 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 0.6930 -0.4770 1.1600 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7700 -1.9020 1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5260 -2.2930 2.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 -3.8180 2.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3330 -4.1920 3.8330 N 0 0 0 0 0 0 0 0 0 0 0 0 1.6030 -4.3980 5.0860 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1850 -5.8420 5.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4690 -6.6220 4.3090 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4950 -6.2660 6.2700 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1100 -7.5980 6.3680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5540 -8.1080 7.3580 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.8370 -9.3950 7.2880 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3920 -10.0020 6.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4350 -8.8010 5.1980 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6710 -4.3480 3.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2710 -4.6580 4.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 4.4230 -4.1360 2.5100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9400 -4.3280 2.5370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3490 -2.9210 2.4230 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2370 -2.3180 1.2830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2960 -2.2920 0.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5330 -1.8760 2.4860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0000 -1.9020 3.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6020 -4.2340 2.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1350 -4.2090 1.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2460 -4.1430 5.9280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -3.7620 5.0990 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 -5.6420 6.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -9.9150 8.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -11.0460 5.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8940 -4.4320 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3960 -4.6070 3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4100 -4.7500 1.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4300 -2.4180 1.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4150 -2.2750 3.2990 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 27 1 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 6 32 1 0 0 0 0 7 8 1 0 0 0 0 7 17 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 35 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 36 1 0 0 0 0 15 16 1 0 0 0 0 15 37 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 21 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 39 1 0 0 0 0 20 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 M END