gly-3w-18O2                                             Thu Feb 16 17:47:55 2023
   5   22   10    0    0.0000E+000    1.0000E+005    1.0000E+000 1.0000000000
a   1 ,1 ,  ,  ,  ,  ,  ,  ,   ,   , 0 ,,,,,
        10000  1.931356982577923E+003 1.00000000E+000 /A
        20000  1.302224467681813E+003 1.00000000E+000 /B
        30000  1.239324149882675E+003 1.00000000E+000 /C
          200 -7.006715580643378E-004 1.00000000E+000 /-DJ
         1100 -2.070852827844817E-003 1.00000000E+000 /-DJK
!
!----------------------------------------------------------------------
!
!                              RMS ERROR=        0.61999         0.61999
!
gly-3w-18O2                                             Thu Feb 16 17:47:55 2023
   5   22   10    0    0.0000E+000    1.0000E+005    1.0000E+000 1.0000000000
a   1 ,1 ,  ,  ,  ,  ,  ,  ,   ,   , 0 ,,,,,
        10000  1.931356982577923E+003 1.00000000E+000 /A
        20000  1.302224467681813E+003 1.00000000E+000 /B
        30000  1.239324149882675E+003 1.00000000E+000 /C
          200 -7.006715580643378E-004 1.00000000E+000 /-DJ
         1100 -2.070852827844817E-003 1.00000000E+000 /-DJK
!
!----------------------------------------------------------------------