PUBCHEM-ZINC05606760 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 47 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -0.5700 -1.1380 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5370 0.0980 -1.9910 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1400 -0.7590 -0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3010 -1.6980 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -3.0530 0.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1830 -2.8640 -0.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0210 -1.9260 -1.4630 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5170 -2.3580 -2.3330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4660 -1.7370 -1.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0700 -3.0700 -2.2120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5570 -2.8810 -2.5140 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1600 -4.2150 -2.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2030 -5.2960 -3.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.6870 -5.0680 -3.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.8220 -4.1810 -5.0890 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.2650 -3.8820 -5.4700 S 0 0 3 0 0 0 0 0 0 0 0 0 -9.9240 -5.0920 -5.8160 O 0 0 0 0 0 0 0 0 0 0 0 0 -10.1090 -3.1150 -4.0730 S 0 0 0 0 0 0 0 0 0 0 0 0 -9.2890 -2.9330 -6.6600 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6350 -1.1910 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5890 0.2060 -0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 -1.8320 0.5780 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8060 -1.2660 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1660 -3.4850 -0.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -3.7220 0.8900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2660 -3.8300 -0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3120 -2.4320 0.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9780 -1.3890 -0.8690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5850 -1.0000 -2.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5580 -3.4190 -3.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9510 -3.8070 -1.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0690 -2.5330 -1.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6760 -2.1450 -3.3090 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6490 -4.5630 -3.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 -4.9510 -2.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0980 -6.0400 -2.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7050 -5.6520 -4.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1620 -6.0200 -4.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1660 -4.6290 -3.1010 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.1780 -2.6990 -6.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5890 -4.0340 -3.2510 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.0740 -3.6500 -2.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 5 26 1 0 0 0 0 6 7 1 0 0 0 0 6 27 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 12 13 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 14 46 1 0 0 0 0 15 16 1 0 0 0 0 15 41 1 0 0 0 0 15 42 1 0 0 0 0 15 46 1 0 0 0 0 16 17 1 0 0 0 0 16 43 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 45 1 0 0 0 0 46 47 1 0 0 0 0 M END