COMGENEX-ZINC04781958 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 56 0 0 0 0 0 0 0 0999 V2000 0.4550 1.2760 -0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4040 -0.2490 -0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3870 -0.9850 -1.4200 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7670 -0.7580 -2.6790 O 0 0 0 0 0 0 0 0 0 0 0 0 2.7700 -0.7200 -1.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2590 -2.4860 -1.2040 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0550 -2.9970 -1.5720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1390 -3.4540 -2.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -3.9730 -3.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3960 -4.0360 -2.3240 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2070 -3.5810 -1.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -3.0670 -0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3350 -3.6510 -0.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2840 -4.9340 0.6700 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5090 -5.0590 1.9080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4030 -4.7270 3.1040 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4420 -5.7030 3.2080 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3370 -5.4840 4.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9490 -5.9990 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5920 -5.8960 -0.8460 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9020 -7.1790 0.8310 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6820 -8.2550 0.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2120 -9.5550 0.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9810 -10.6150 0.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2220 -10.3820 -0.4920 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6920 -9.0840 -0.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9260 -8.0230 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9790 -11.4260 -0.9240 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.2460 -11.1130 -1.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4890 1.6120 -0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0480 1.5840 -1.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1350 1.7180 0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8120 -0.5570 0.8780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 -0.5850 -0.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -3.4040 -3.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5140 -4.3290 -4.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3530 -4.4420 -2.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8320 -2.7160 0.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2360 -2.8370 0.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2870 -3.5620 -0.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1390 -6.0790 2.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6670 -4.3670 1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8060 -4.7330 4.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8440 -3.7400 2.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7800 -5.5060 5.2370 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8190 -4.5130 4.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0960 -6.2670 4.3100 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3290 -7.2830 1.6060 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 -9.7370 0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6160 -11.6260 0.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6580 -8.9020 -1.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2940 -7.0120 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8610 -10.5880 -0.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0980 -10.4770 -2.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.7460 -12.0340 -1.8060 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 33 1 0 0 0 0 2 34 1 0 0 0 0 3 4 2 0 0 0 0 3 5 2 0 0 0 0 3 6 1 0 0 0 0 6 7 1 0 0 0 0 7 8 1 0 0 0 0 7 12 2 0 0 0 0 8 9 2 0 0 0 0 8 35 1 0 0 0 0 9 10 1 0 0 0 0 9 36 1 0 0 0 0 10 11 2 0 0 0 0 10 37 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 18 45 1 0 0 0 0 18 46 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 48 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 49 1 0 0 0 0 24 25 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 28 1 0 0 0 0 26 27 1 0 0 0 0 26 51 1 0 0 0 0 27 52 1 0 0 0 0 28 29 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 M END