PUBCHEM-ZINC06031736 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 51 0 0 1 0 0 0 0 0999 V2000 0.3630 1.2560 -0.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3920 -0.2450 -0.4110 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.6250 -0.6410 -0.5100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0110 -0.7030 0.9250 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2560 -0.7280 1.7190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -2.1040 0.6160 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8910 -2.0070 -0.8090 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2450 -0.9640 -1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3250 -0.7060 -2.6230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5920 -3.2500 0.9320 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4530 -3.2870 2.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -4.6320 0.4270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 -5.8110 0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -7.1020 0.1450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 -5.9940 2.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6870 -2.9470 0.3680 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.3370 -3.5840 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8610 -2.3210 1.4890 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8070 -2.2700 2.7150 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 -2.6900 0.6380 S 0 0 0 0 0 0 0 0 0 0 0 0 5.5470 -2.6660 2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9740 -2.9940 1.5630 C 0 0 3 0 0 0 0 0 0 0 0 0 7.3140 -2.3230 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7870 -2.7430 2.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9700 -3.7840 3.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1230 -4.3910 1.1210 N 0 0 0 0 0 0 0 0 0 0 0 0 7.3130 -5.0340 1.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0600 -4.8250 -0.1790 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8780 -4.1070 -1.1570 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2160 -6.3160 -0.3070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 0.2380 1.3270 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2360 0.0600 2.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3710 1.6770 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1560 1.4880 -1.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1640 1.7660 0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5140 -2.6220 -1.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1740 -4.5880 -0.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0490 -4.8580 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -5.6330 0.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8230 -7.0040 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6550 -7.3500 0.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -7.9440 0.3190 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6570 -5.1440 2.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7180 -6.8890 2.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8320 -6.1020 2.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5030 -1.6700 2.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2110 -3.3940 2.7700 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2630 -6.8000 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5110 -6.5680 -1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9860 -6.6850 0.3770 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1750 -1.5580 3.0530 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 31 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 6 18 1 0 0 0 0 7 8 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 16 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 12 38 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 46 1 0 0 0 0 21 47 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 26 1 0 0 0 0 24 25 2 0 0 0 0 24 51 1 0 0 0 0 26 27 1 0 0 0 0 26 28 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 48 1 0 0 0 0 30 49 1 0 0 0 0 30 50 1 0 0 0 0 31 32 1 0 0 0 0 M CHG 1 51 -1 M END