1,2-dichlorobenzene: 37Cl, nu16 ca 152cm-1 Thu Apr 02 11:14:26 2020 9 332 3 0 0.0000E+000 3.0000E+000 1.0000E+000 1.0000000000 'a' 1 1 , 0 , 130, , 1 , , , , , , 10000 1.892560944795913E+003 1.00000000E+000 /A 20000 1.413733602548649E+003 1.00000000E+000 /B 30000 8.102846179823958E+002 1.00000000E+000 /C 200 -4.150690794190290E-005 1.00000000E+000 /-DJ 1100 1.736865952416116E-005 1.00000000E+000 /-DJK 2000 -4.424882271410516E-004 1.00000000E+000 /-DK 40100 -1.408937669150197E-005 1.00000000E+000 /-dJ 41000 -1.838245487512843E-005 1.00000000E+000 /-dK 42000 1.117803153051077E-010 1.00000000E+000 /hK ! !------------------------------------------------------------------------------- ! Final: the only sextic used is hK ! ! RMS ERROR= 0.92816 0.92816 ! 1,2-dichlorobenzene: 37Cl, nu16 ca 152cm-1 Thu Apr 02 11:14:26 2020 9 332 3 0 0.0000E+000 3.0000E+000 1.0000E+000 1.0000000000 'a' 1 1 , 0 , 130, , 1 , , , , , , 10000 1.892560944795913E+003 1.00000000E+000 /A 20000 1.413733602548649E+003 1.00000000E+000 /B 30000 8.102846179823958E+002 1.00000000E+000 /C 200 -4.150690794190290E-005 1.00000000E+000 /-DJ 1100 1.736865952416116E-005 1.00000000E+000 /-DJK 2000 -4.424882271410516E-004 1.00000000E+000 /-DK 40100 -1.408937669150197E-005 1.00000000E+000 /-dJ 41000 -1.838245487512843E-005 1.00000000E+000 /-dK 42000 1.117803153051077E-010 1.00000000E+000 /hK ! !-------------------------------------------------------------------------------