H35Cl...14N 14N, I,I1,F coupling Wed Jun 01 07:59:58 2011 6 119 5 0 0.0000E+000 1.0000E+020 1.0000E+000 1.0000000000 s -334 1 0 ,0 , , -1 , , , , , 0 20000 1.745662380445310E+003 1.00000000E+017 / B -30000 1.745662380445310E+003 1.00000000E-037 / C 200 -8.322572572634950E-003 1.00000000E+017 /-DJ 110010000 -7.226361934419880E+001 1.00000000E+017 /Cl:X_a*3/2 220010000 -6.659511158526080E+000 1.00000000E+000 /N1:X_a*3/2 330010000 -6.927920622613200E+000 1.00000000E+000 /N2:X_a*3/2 ! !------------------------------------------------------------------------------- ! Refit: ! RMS ERROR= 0.95702 0.95702 ! ! H35Cl...14N 14N, I,I1,F coupling Wed Jun 01 07:59:58 2011 6 119 5 0 0.0000E+000 1.0000E+020 1.0000E+000 1.0000000000 s -334 1 0 ,0 , , -1 , , , , , 0 20000 1.745662380445310E+003 1.00000000E+017 / B -30000 1.745662380445310E+003 1.00000000E-037 / C 200 -8.322572572634950E-003 1.00000000E+017 /-DJ 110010000 -7.226361934419880E+001 1.00000000E+017 /Cl:X_a*3/2 220010000 -6.659511158526080E+000 1.00000000E+000 /N1:X_a*3/2 330010000 -6.927920622613200E+000 1.00000000E+000 /N2:X_a*3/2 ! !------------------------------------------------------------------------------- ! Legacy ! H35Cl...14N 14N, I,I1,F coupling 18:58:33.91 1/13/1999 6 200 5 0 .1000E-11 .1000E+21 .1000E+01 1.0000000000 s -334 1 0 ,0 , , -1 , , , , , 20000. .174566238044531E+04 .10000000E+18/ B -30000. .174566238044531E+04 .10000000E+18/ C 200. -.832257257263495E-02 .10000000E+18/-DJ 110010000. -.722636193441988E+02 .10000000E+18/chi.aa*3/2 220010000. -.665951115852608E+01 .10000000E+01/chi.aa*3/2 330010000. -.692792062261320E+01 .10000000E+01/ ! !-------------------------------------------------------------------------------