1,2-dichlorobenzene: 37Cl, nu20 ca 239cm-1 Thu Apr 02 11:32:33 2020 9 240 5 0 0.0000E+000 3.0000E+000 1.0000E+000 1.0000000000 'a' 1 1 , 0 , 130, , 1 , , , , , , 10000 1.893887045721616E+003 1.00000000E+000 /A 20000 1.415301127827049E+003 1.00000000E+000 /B 30000 8.104793248870345E+002 1.00000000E+000 /C 200 -4.181477293610830E-005 1.00000000E+000 /-DJ 1100 1.790252305152310E-005 1.00000000E+000 /-DJK 2000 -4.387225164046285E-004 1.00000000E+000 /-DK 40100 -1.424021966142451E-005 1.00000000E+000 /-dJ 41000 -2.120712965657951E-005 1.00000000E+000 /-dK 42000 1.508738218454240E-010 1.00000000E+000 /hK ! !------------------------------------------------------------------------------- ! Final: the only sextic used is hK ! ! RMS ERROR= 1.14158 1.14158 ! 1,2-dichlorobenzene: 37Cl, nu20 ca 239cm-1 Thu Apr 02 11:32:33 2020 9 240 5 0 0.0000E+000 3.0000E+000 1.0000E+000 1.0000000000 'a' 1 1 , 0 , 130, , 1 , , , , , , 10000 1.893887045721616E+003 1.00000000E+000 /A 20000 1.415301127827049E+003 1.00000000E+000 /B 30000 8.104793248870345E+002 1.00000000E+000 /C 200 -4.181477293610830E-005 1.00000000E+000 /-DJ 1100 1.790252305152310E-005 1.00000000E+000 /-DJK 2000 -4.387225164046285E-004 1.00000000E+000 /-DK 40100 -1.424021966142451E-005 1.00000000E+000 /-dJ 41000 -2.120712965657951E-005 1.00000000E+000 /-dK 42000 1.508738218454240E-010 1.00000000E+000 /hK ! !-------------------------------------------------------------------------------