c
c
c     ################################################################
c     ##  COPYRIGHT (C) 2009 by Chuanjie Wu and Jay William Ponder  ##
c     ##                    All Rights Reserved                     ##
c     ################################################################
c
c     ################################################################
c     ##                                                            ##
c     ##   qmstuf.i  --  quantum data from Gaussian 09 calculation  ##
c     ##                                                            ##
c     ################################################################
c
c   
c     gx       x-coordinate of each atom in the QM data file
c     gy       y-coordinate of each atom in the QM data file
c     gz       z-coordinate of each atom in the QM data file
c     gforce   force components on each atom from QM data
c     gh       Hessian matrix elements from QM data
c     gfreq    calculated vibrational frequencies from QM data
c     egau     quantum mechanical (QM) total energy (kcal/mole)
c     ngatom   number of atoms in the QM data file
c
c
      integer ngatom
      real*8 gx,gy,gz
      real*8 gforce,gh
      real*8 gfreq,egau
      common /qmstuf/ gx(maxatm),gy(maxatm),gz(maxatm),gforce(3,maxatm),
     &                gh(maxhess),gfreq(3*maxatm),egau,ngatom