CHEMBRIDGE-ZINC01172396 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 62 0 0 1 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 0.7180 -0.4980 -1.2570 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7340 -1.5870 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1540 0.0360 -1.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9370 -0.6600 -2.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -0.5660 -3.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8360 -0.2680 -3.7200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2540 -0.2490 -5.3770 S 0 0 0 0 0 0 0 0 0 0 0 0 1.7850 -0.6470 -6.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -0.7880 -4.9990 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1060 -1.1280 -5.2300 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4540 -2.2940 -5.2540 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0150 -0.1500 -5.4160 N 0 0 0 0 0 0 0 0 0 0 0 0 6.4520 -0.3500 -5.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0930 1.0480 -5.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0810 1.9630 -5.0440 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 1.2970 -5.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0670 -0.8070 -7.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0910 -0.6460 -8.2680 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0360 -0.3600 -7.9130 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3910 -0.8160 -9.7040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3820 -0.6500 -10.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6680 -0.8090 -11.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9540 -1.1350 -12.3980 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9590 -1.3010 -11.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6860 -1.1390 -10.1160 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2280 -1.2910 -13.7110 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.0180 0.0130 -2.4980 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 0.2320 -0.1590 2.1380 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 -1.9600 -0.1730 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4180 -1.6240 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9440 -0.1820 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1420 1.1100 -1.4510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -0.1690 -0.3120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9020 -0.1700 -2.5170 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0900 -1.7080 -2.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8960 -0.8870 -4.8200 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5980 -0.9100 -6.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0660 1.0720 -5.2910 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1820 1.3390 -6.8300 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2470 1.9390 -3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1290 2.9840 -5.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 1.6180 -6.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9720 1.5350 -4.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9660 -1.0350 -7.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6200 -0.3960 -10.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1120 -0.6810 -12.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 -1.5550 -11.7770 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 -1.2640 -9.3850 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9750 -0.5020 -2.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1860 1.0860 -2.4090 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 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 31 1 0 0 0 0 7 8 1 0 0 0 0 7 41 1 0 0 0 0 7 42 1 0 0 0 0 8 9 1 0 0 0 0 8 43 1 0 0 0 0 8 44 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 31 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 12 21 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 20 1 0 0 0 0 17 18 1 0 0 0 0 17 45 1 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 56 1 0 0 0 0 29 57 1 0 0 0 0 31 58 1 0 0 0 0 31 59 1 0 0 0 0 M END