ZPE (cm-1)
  2535.78222246d0   626
  2483.00628744d0   636 
  2502.52561747d0   628 
  2518.26941578d0   627 
partition value
       296K           1000K           2000K           3000K            4000K         ISO
   286.0968d0      2838.5914d0     24622.4768d0    114756.4084d0    378049.9905d0    626
   288.3243d0      2948.0739d0     26040.5327d0    122333.0272d0    403145.4816d0    636 
   607.8361d0      6137.0117d0     53904.1630d0    252427.7010d0    829450.4635d0    628 
   590.4432d0      5911.7464d0     51616.6170d0    241099.0497d0    791470.9557d0    627