COMGENEX-ZINC04491049 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 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 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4330 -0.5340 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4160 -1.9930 -0.1160 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5750 -2.6820 -0.1300 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6340 -2.0920 -0.0360 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5580 -4.1540 -0.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7560 -4.8700 -0.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7330 -6.2440 -0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5260 -6.9130 -0.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3350 -6.2090 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3440 -4.8340 -0.3730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5080 -8.4140 -0.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -8.8670 -2.3850 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.5380 -10.6230 -2.2480 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5700 -11.3580 -3.3510 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -12.6850 -3.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 -13.2970 -2.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4580 -12.4950 -0.9030 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4780 -11.1760 -1.0460 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3860 -13.2050 0.6800 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 -13.4500 -4.4370 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6400 -12.5960 -5.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6160 -13.4770 -6.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7010 -14.4070 -6.8270 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6740 -15.2550 -5.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7090 -14.3910 -4.4120 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 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7570 -1.6010 1.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9160 -0.2570 0.9500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9860 -0.1020 -0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -2.4640 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6980 -4.3500 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6590 -6.8000 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3960 -6.7360 -0.5720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4140 -4.2850 -0.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5950 -8.8070 -0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3730 -8.8340 -0.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4700 -14.3740 -1.9400 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5600 -12.0120 -5.6160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7820 -11.9240 -5.6430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7170 -12.8520 -7.7710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6720 -14.0220 -6.9270 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5410 -15.9150 -5.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7620 -15.8510 -5.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6310 -15.0300 -3.5320 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6460 -13.8360 -4.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 32 1 0 0 0 0 3 33 1 0 0 0 0 3 34 1 0 0 0 0 3 35 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 39 1 0 0 0 0 10 11 1 0 0 0 0 10 40 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 41 1 0 0 0 0 13 42 1 0 0 0 0 14 15 1 0 0 0 0 14 43 1 0 0 0 0 14 44 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 23 24 1 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 M END