PUBCHEM-ZINC05966521 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 0.1340 0.6850 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 1.0220 2.4960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6770 1.6320 3.6600 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 3.3640 2.2160 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7950 2.7920 1.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6530 3.6100 4.6620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6590 5.1490 4.7580 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2330 7.0580 6.3520 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.2340 7.3770 6.0250 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2800 7.7870 5.5280 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 8.6660 4.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8230 9.3350 3.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1820 9.1400 3.9570 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5990 8.2760 4.9660 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6570 7.6000 5.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3060 7.3770 7.8410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6100 8.4970 8.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 8.8180 9.6940 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 8.0290 10.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 6.9270 10.1060 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0550 6.6040 8.7460 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4100 8.4200 12.2490 Cl 0 0 0 0 0 0 0 0 0 0 0 0 0.2010 -0.3920 0.1880 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 1.1330 -0.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 0.8820 -0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 1.4490 2.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1890 -0.0660 2.6040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6390 1.1080 3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1160 1.4440 4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6540 4.4460 2.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 2.9520 2.2180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3680 2.9310 0.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 3.2590 0.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1850 3.2310 5.5800 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6850 3.2340 4.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6400 5.5480 4.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 5.5980 3.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8230 8.8490 4.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4990 10.0150 2.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9170 9.6690 3.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6620 8.1370 5.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0230 6.9440 6.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0330 9.1360 7.6670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0910 9.6840 10.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6660 6.3170 10.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 5.7440 8.4220 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5810 1.3010 1.1840 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.5100 0.8610 1.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9000 3.0870 3.5050 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 5.5670 6.0840 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.1920 5.2200 6.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6820 5.1280 6.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 1 47 1 0 0 0 0 2 3 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 2 47 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 49 1 0 0 0 0 4 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 49 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 5 47 1 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 6 49 1 0 0 0 0 7 36 1 0 0 0 0 7 37 1 0 0 0 0 7 50 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 16 1 0 0 0 0 8 50 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 38 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 13 14 2 0 0 0 0 13 40 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 15 42 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 21 46 1 0 0 0 0 47 48 1 0 0 0 0 50 51 1 0 0 0 0 50 52 1 0 0 0 0 M CHG 1 47 1 M CHG 1 50 1 M END