PUBCHEM-ZINC03130219 MOE2007 3D CORINA 3.40 0006 02.08.2006 39 40 0 0 1 0 0 0 0 0999 V2000 0.6430 2.1870 0.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2000 0.8410 0.3240 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4920 0.7830 -0.7250 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8690 -0.2930 1.1030 C 0 0 3 0 0 0 0 0 0 0 0 0 0.2910 -1.6350 0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6120 -0.1100 2.5760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3780 -0.7940 3.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1420 -0.6270 4.8540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 0.2260 5.2800 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6250 0.9100 4.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3860 0.7460 3.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6560 -0.2680 0.7930 S 0 0 0 0 0 0 0 0 0 0 0 0 2.7570 -0.4390 -0.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5990 -0.5930 -1.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6830 -0.7260 -3.0820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 -0.7070 -3.7070 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0710 -0.5540 -2.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9950 -0.4140 -1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2300 -0.2440 -0.7920 N 0 3 0 0 0 0 0 0 0 0 0 0 6.3150 -0.2220 -1.3470 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1630 -0.1250 0.4180 O 0 5 0 0 0 0 0 0 0 0 0 0 3.0020 -0.8500 -5.1780 N 0 3 0 0 0 0 0 0 0 0 0 0 1.9860 -0.9850 -5.8370 O 0 0 0 0 0 0 0 0 0 0 0 0 4.0870 -0.8340 -5.7300 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.5910 0.6890 0.4590 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.7240 2.2880 0.8020 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 2.9950 0.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3700 2.2370 1.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -1.9340 -0.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4830 -2.3910 1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7840 -1.5350 0.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1600 -1.4600 3.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7400 -1.1620 5.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0440 0.3560 6.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4080 1.5760 4.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 1.2830 2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -0.6080 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7830 -0.8460 -3.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0320 -0.5400 -3.4520 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 4 1 0 0 0 0 2 25 1 0 0 0 0 4 5 1 0 0 0 0 4 6 1 0 0 0 0 4 12 1 0 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 11 2 0 0 0 0 7 8 2 0 0 0 0 7 32 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 2 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 14 15 2 0 0 0 0 14 37 1 0 0 0 0 15 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 39 1 0 0 0 0 18 19 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 M CHG 1 19 1 M CHG 1 21 -1 M CHG 1 22 1 M CHG 1 24 -1 M END