PUBCHEM-ZINC06136409 MOE2007 3D CORINA 3.40 0006 02.08.2006 73 77 0 0 0 0 0 0 0 0999 V2000 -0.8600 1.0860 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4240 -0.2480 0.4230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5420 -0.7540 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1320 -0.0380 2.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 -0.6220 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5020 -1.9430 2.8630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9200 -2.6670 1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 -2.0840 1.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3190 -2.7140 -0.0400 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5510 -4.1130 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3200 -4.6510 -1.3210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1610 -5.6680 -2.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6470 -6.2020 -3.1640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -5.7330 -3.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4430 -4.7320 -2.5040 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6360 -4.1980 -1.4970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7370 0.1450 4.2240 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6170 1.1930 3.9050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2250 1.9290 4.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9920 1.6520 6.2220 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1370 0.6510 6.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4890 -0.1280 5.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5780 -1.1670 5.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8460 -2.0040 6.3060 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9010 0.3740 8.3040 S 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 1.8940 8.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5140 1.8800 10.5050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 2.8520 12.5810 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3010 4.0260 13.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5630 5.3450 12.9510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1840 5.5540 11.4900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 4.3750 10.9370 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1600 3.0410 4.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2750 3.2460 5.4990 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1720 4.2950 5.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9690 5.1670 4.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8720 4.9910 3.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9760 3.9400 3.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0380 1.7970 0.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 1.3170 -0.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3190 1.1910 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8340 0.9860 2.5200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2700 -2.4240 3.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -3.6830 1.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6040 -4.2710 -0.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -4.6590 0.7100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 -6.0540 -2.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2630 -6.9860 -3.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5770 -6.1490 -4.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4580 -4.3680 -2.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0380 -3.4200 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8390 1.4100 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6990 1.9440 8.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1220 2.7570 8.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 1.8850 10.8440 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0210 0.9990 10.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1060 1.9340 12.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5610 2.7080 13.1070 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4940 3.8630 14.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2790 4.0800 12.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6570 5.3500 13.5690 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1910 6.1750 13.2950 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5890 6.4700 11.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0930 5.7010 10.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4390 4.2440 11.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2200 4.5130 9.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4570 2.5740 6.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0280 4.4280 5.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6660 5.9820 4.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7100 5.6740 2.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1210 3.8470 2.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1950 3.0990 11.1200 N 0 3 0 0 0 0 0 0 0 0 0 0 5.0990 3.2240 10.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 2 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 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 47 1 0 0 0 0 13 14 1 0 0 0 0 13 48 1 0 0 0 0 14 15 2 0 0 0 0 14 49 1 0 0 0 0 15 16 1 0 0 0 0 15 50 1 0 0 0 0 16 51 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 52 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 20 21 2 0 0 0 0 21 22 1 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 23 24 3 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 55 1 0 0 0 0 27 56 1 0 0 0 0 27 72 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 28 72 1 0 0 0 0 29 30 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 30 31 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 31 32 1 0 0 0 0 31 63 1 0 0 0 0 31 64 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 32 72 1 0 0 0 0 33 34 1 0 0 0 0 33 38 2 0 0 0 0 34 35 2 0 0 0 0 34 67 1 0 0 0 0 35 36 1 0 0 0 0 35 68 1 0 0 0 0 36 37 2 0 0 0 0 36 69 1 0 0 0 0 37 38 1 0 0 0 0 37 70 1 0 0 0 0 38 71 1 0 0 0 0 72 73 1 0 0 0 0 M CHG 1 72 1 M END