text: # -*- coding: utf-8 -*-
  """
  Created on Sat May 20 15:00:49 2017
  
  @author: wittregr
  """
  
  import sys
  import os
  
  HomePath = os.path.expanduser('~')
  sys.path.append(os.path.join(HomePath,'Documents','GitHub'))
  sys.path.append(os.path.join(HomePath,'Documents','GitHub', 'Zacros-Wrapper'))
  sys.path.append(os.path.join(HomePath,'Documents','GitHub', 'Zacros-Wrapper','zacros_wrapper'))
  
  import zacros_wrapper as zw
  
  
  x = zw.kmc_traj()
  
  x.Path = os.path.join(os.getcwd(), 'input')
  x.ReadAllInput()
  
  
  
  T = 650
  filepath = os.path.join(x.Path, "Zacros_Species_Energy.xlsx")
  x.mechin.CalcThermo(filepath,T)
  
  
  x.Path = os.path.join(os.getcwd(), 'output')
  x.WriteAllInput()
  