PUBCHEM-ZINC03702974 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.4860 1.7210 -0.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1880 0.2480 -0.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7300 -0.2250 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1120 -0.1930 2.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -0.7330 3.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1520 -1.1730 3.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2950 -0.9070 1.3940 S 0 0 0 0 0 0 0 0 0 0 0 0 3.2830 -1.8020 3.8620 C 0 0 3 0 0 0 0 0 0 0 0 0 3.0330 -1.7850 4.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5560 -3.2570 3.5000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4970 -4.1770 3.3860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7340 -5.5190 3.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0350 -5.9720 2.8750 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0970 -5.0730 3.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8740 -3.7270 3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 -2.8010 3.4620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7390 -1.5630 4.2900 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4080 -7.2480 2.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3770 -8.2300 2.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0200 -9.5720 2.2140 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9180 -10.1070 3.1510 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5110 -11.3520 2.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2120 -12.0750 1.7800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3210 -11.5530 0.8430 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7260 -10.3070 1.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5640 1.9110 -0.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0670 2.0430 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0490 2.3450 0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8980 0.0920 -0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6010 -0.3460 -0.8460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8850 0.2010 2.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6260 -0.7980 4.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4650 -3.8620 3.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8760 -6.1790 2.9820 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1120 -5.4380 2.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8990 -3.3270 3.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3720 -2.5040 2.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5510 -1.7990 5.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5410 -0.8220 4.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -8.2920 3.3990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6990 -7.9770 1.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1620 -9.5500 4.0530 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2060 -11.7570 3.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6740 -13.0430 1.6100 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0890 -12.1150 -0.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0340 -9.9200 0.3150 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5060 -0.9270 3.7500 N 0 3 0 0 0 0 0 0 0 0 0 0 4.6350 -0.7020 2.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -0.0320 4.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 2 0 0 0 0 3 7 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 5 6 2 0 0 0 0 5 32 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 47 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 35 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 17 47 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 20 21 1 0 0 0 0 20 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 47 48 1 0 0 0 0 47 49 1 0 0 0 0 M CHG 1 47 1 M END