

   NSTEP       ENERGY          RMS            GMAX         NAME    NUMBER
      1      -6.2068E+03     2.5902E+01     3.0893E+02     O        2308

 BOND    =        0.0439  ANGLE   =        0.0000  DIHED      =        0.0000
 VDWAALS =     2540.7743  EEL     =    -8747.6151  HBOND      =        0.0000
 1-4 VDW =        0.0000  1-4 EEL =        0.0000  RESTRAINT  =        0.0000
