PUBCHEM-ZINC05995992 MOE2007 3D CORINA 3.40 0006 02.08.2006 28 29 0 0 0 0 0 0 0 0999 V2000 -0.1490 1.1590 0.0830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.2050 0.3380 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2890 -0.7900 0.2770 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4050 -0.0100 -0.0520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2200 1.3700 -0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9540 1.9680 -0.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8380 3.3430 -0.5060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1540 3.9430 0.3530 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 5.3070 0.1810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0160 5.9720 -0.1820 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9850 7.3360 -0.3090 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8280 7.8160 -0.5910 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1050 8.1290 -0.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0710 9.3480 -0.2220 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2350 7.4670 0.3040 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0570 8.0240 0.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 6.1060 0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3820 5.5980 0.8660 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2030 5.3440 -0.4380 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7850 -0.5820 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9340 -1.5790 -0.9460 O 0 5 0 0 0 0 0 0 0 0 0 0 1.4030 -2.4690 0.6700 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 1.5900 0.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -0.8110 0.5870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0870 1.9850 -0.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2390 4.3310 -0.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0310 5.8670 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7030 0.0050 0.4790 O 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 23 1 0 0 0 0 2 3 2 0 0 0 0 2 24 1 0 0 0 0 3 4 1 0 0 0 0 3 22 1 0 0 0 0 4 5 2 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 25 1 0 0 0 0 6 7 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 19 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 2 0 0 0 0 19 26 1 0 0 0 0 19 27 1 0 0 0 0 20 21 1 0 0 0 0 20 28 2 0 0 0 0 M CHG 1 21 -1 M END