%nproc=32 
%mem = 60GB 
%chk=Cl4F_isomer_36_0.chk 
#P opt EmpiricalDispersion=GD3BJ integral(grid=ultrafinegrid) GFInput pop=full IOP(3/74=-78) IOP(6/7=3) IOP(3/5=10) IOP(3/175=01217700) IOP(3/177=414500) IOP(3/178=4859300) SCF=YQC 
 
Cl4F_isomer_36_0 opt 
 
-1 1
C        0.00000000      -0.70583900      -0.00000000
C        0.00000000       0.70583900      -0.00000000
C        1.22748100      -1.39382500      -0.00000000
C       -1.22748100       1.39382500       0.00000000
C       -1.22748100      -1.39382500      -0.00000000
C        1.22748100       1.39382500      -0.00000000
C        2.38788100      -0.70117800       0.00000000
C       -2.38788100       0.70117800       0.00000000
C       -2.38788100      -0.70117800      -0.00000000
C        2.38788100       0.70117800      -0.00000000
F       -3.55067200       1.31982800      -0.00000000
F        3.55067200      -1.31982800       0.00000000
F       -3.55067200      -1.31982800      -0.00000000
F        3.55067200       1.31982800       0.00000000
H       -1.25650000       2.47197800       0.00000000
H        1.25650000      -2.47197800       0.00000000
H        1.25650000       2.47197800      -0.00000000
H       -1.25650000      -2.47197800      -0.00000000
Cl       0.00000000      -2.47197800       2.00000000