PUBCHEM-ZINC03746311 MOE2007 3D CORINA 3.40 0006 02.08.2006 42 44 0 0 0 0 0 0 0 0999 V2000 -0.7880 1.3740 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 0.0810 0.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3340 -0.9480 1.3220 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -2.0890 0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3570 -3.0030 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4090 -4.1890 -0.0840 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5220 -4.4610 -0.8780 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5850 -3.5570 -0.9500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5440 -2.3540 -0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6750 -1.4190 -0.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3950 -0.8990 -1.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3960 -0.0240 -0.8230 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4150 0.7770 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2440 1.5470 -0.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0590 1.5220 0.8290 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 0.7350 1.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2470 -0.0230 0.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2010 -0.8620 0.8460 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.8500 -1.0490 1.7750 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.1900 2.2800 -1.2210 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.0950 3.0390 -0.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1590 -1.1360 -2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2600 -2.0010 -3.4420 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1290 -3.2490 -3.2820 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 -5.9340 -1.7660 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.2700 2.1950 0.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8440 1.6390 1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3760 1.2620 2.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0690 0.2170 -0.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4180 -0.1750 0.5110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4990 -2.7910 1.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 -4.8970 -0.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 -3.8010 -1.5590 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5630 0.7880 -2.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6830 2.1080 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9180 0.7190 2.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5700 3.8160 0.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.7930 3.5380 -1.1100 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6810 2.3930 0.2310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1190 -0.1710 -3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1880 -1.6110 -3.0080 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1520 -1.3680 -4.0780 O 0 5 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 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 7 8 2 0 0 0 0 7 25 1 0 0 0 0 8 9 1 0 0 0 0 8 33 1 0 0 0 0 9 10 1 0 0 0 0 10 11 2 0 0 0 0 10 18 1 0 0 0 0 11 12 1 0 0 0 0 11 22 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 34 1 0 0 0 0 14 15 1 0 0 0 0 14 20 1 0 0 0 0 15 16 2 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 17 18 1 0 0 0 0 18 19 1 0 0 0 0 20 21 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 22 41 1 0 0 0 0 23 24 2 0 0 0 0 23 42 1 0 0 0 0 M CHG 1 42 -1 M END