PUBCHEM-ZINC01208861 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 0 0 0 0 0 0999 V2000 -0.0170 1.3780 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2080 -0.6790 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3960 0.0290 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3770 1.4110 -0.0140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1710 2.0860 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6490 2.1680 -0.0220 N 0 3 0 0 0 0 0 0 0 0 0 0 4.7120 1.5740 -0.0340 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 3.3860 -0.0160 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2290 -2.1860 -0.0200 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4790 -4.1140 -1.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6430 -4.5440 -2.9250 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4640 -4.0930 -3.6800 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0620 -2.6830 -3.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 -2.3260 -2.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3870 -5.1440 -4.6350 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0570 -4.3520 -5.6060 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5090 -6.1950 -4.9730 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6410 -5.8640 -3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8830 -5.2640 -3.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8680 -5.8280 -2.7480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6100 -6.9940 -2.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3670 -7.5950 -2.1420 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3850 -7.0330 -2.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8460 -7.7030 -1.0580 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.9590 1.9060 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9260 -0.5570 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3380 -0.4980 -0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1660 0.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1290 -2.5390 0.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3490 -2.5630 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6410 -4.6500 -1.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3910 -4.3430 -0.9120 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5410 -4.0890 -3.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7200 -5.6300 -2.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8090 -2.0490 -4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9060 -2.5380 -4.0430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2290 -1.2580 -1.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8570 -2.8860 -1.6240 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0840 -4.3540 -4.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8380 -5.3590 -2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1650 -8.5050 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4160 -7.5040 -3.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2220 -2.6690 -1.4080 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 28 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 10 44 1 0 0 0 0 11 12 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 11 44 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 1 0 0 0 0 13 16 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 15 44 1 0 0 0 0 16 17 2 0 0 0 0 16 18 2 0 0 0 0 16 19 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 42 1 0 0 0 0 24 43 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END