PUBCHEM-ZINC05649402 MOE2007 3D CORINA 3.40 0006 02.08.2006 62 63 0 0 1 0 0 0 0 0999 V2000 0.3630 0.7640 -2.6810 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -0.6640 -2.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9520 -1.1020 -1.6140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9230 -2.5120 -1.0190 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.1710 -2.5430 -0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2740 -2.9290 -0.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4170 -4.4400 -0.6580 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.4740 -5.0000 0.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6030 -3.6040 -2.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0980 -6.0800 -2.1430 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6640 -4.7060 -1.5200 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6550 -4.5350 -2.7370 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.7840 -5.1100 -0.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.7480 -5.1980 0.2010 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0650 -5.3950 -1.4790 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.8940 -5.4970 -2.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6860 -6.7360 -0.9680 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.8400 -6.6460 0.1140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7750 -7.9470 -1.2360 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.8400 -7.8630 -0.6710 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4750 -9.2560 -0.8750 C 0 0 3 0 0 0 0 0 0 0 0 0 -6.5580 -9.3660 0.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8480 -9.3460 -1.5410 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.7010 -9.4290 -2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6940 -8.0960 -1.2540 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.5770 -8.1370 -1.9010 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9850 -6.8950 -1.5900 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.3500 -8.0890 0.4590 S 0 0 0 0 0 0 0 0 0 0 0 0 -10.3590 -6.5900 0.3660 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.4810 -10.5660 -1.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.9750 -10.3870 -0.3140 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6580 -10.3400 -1.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.2290 -11.1350 -1.2970 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4020 -8.0130 -2.6170 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0800 -8.9320 -2.7440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0690 -4.2160 -1.2960 C 0 0 3 0 0 0 0 0 0 0 0 0 -7.3600 -4.1430 -0.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5130 -2.8690 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.2640 -4.4340 -2.0540 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4460 -5.4000 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3450 1.0570 -3.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3650 0.8630 -3.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 1.4650 -1.8860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7220 -1.3270 -2.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -0.7340 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2740 -0.3960 -0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -1.0510 -2.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2950 -2.7050 0.6510 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1010 -2.3690 -0.8740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 -3.5050 -2.9640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4660 -3.7170 -2.2270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -5.8980 -3.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -6.8750 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0580 -6.3390 -2.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7280 -5.7110 0.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.0850 -6.6660 -0.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9040 -6.4670 1.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2870 -2.0960 -1.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6660 -2.5530 -1.1280 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1960 -2.9050 -2.7910 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0830 -4.8360 -1.3100 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.4160 -5.0050 -0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 41 1 0 0 0 0 1 42 1 0 0 0 0 1 43 1 0 0 0 0 2 3 1 0 0 0 0 2 44 1 0 0 0 0 2 45 1 0 0 0 0 3 4 1 0 0 0 0 3 46 1 0 0 0 0 3 47 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 9 1 0 0 0 0 6 7 1 0 0 0 0 6 48 1 0 0 0 0 6 49 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 7 61 1 0 0 0 0 9 50 1 0 0 0 0 9 51 1 0 0 0 0 9 61 1 0 0 0 0 10 52 1 0 0 0 0 10 53 1 0 0 0 0 10 54 1 0 0 0 0 10 61 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 36 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 27 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 19 34 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 32 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 23 30 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 30 31 1 0 0 0 0 32 33 1 0 0 0 0 34 35 1 0 0 0 0 36 37 1 0 0 0 0 36 38 1 0 0 0 0 36 39 1 0 0 0 0 38 58 1 0 0 0 0 38 59 1 0 0 0 0 38 60 1 0 0 0 0 39 40 1 0 0 0 0 61 62 1 0 0 0 0 M CHG 1 61 1 M END