%nproc=32 
%mem = 60GB 
%chk=Cl5F_isomer_58_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
 
Cl5F_isomer_58_0 opt 
 
-1 1
C        0.02966000       0.80884200      -0.00000000
C       -0.15600200      -0.58867600      -0.00000000
C        0.96645700      -1.43549200       0.00000000
C       -1.11222900       1.62429000      -0.00000000
C        1.33124700       1.33998200       0.00000000
C       -1.46224800      -1.09910900      -0.00000000
C        2.20409100      -0.89239600       0.00000000
C       -2.36785500       1.12146500      -0.00000000
C        2.38868600       0.49968400       0.00000000
C       -2.53099200      -0.26556900       0.00000000
F       -0.93531900       2.93458800       0.00000000
F       -1.64070400      -2.40650200       0.00000000
F        3.27641600      -1.65257300      -0.00000000
F        3.62241100       0.95652500      -0.00000000
F       -3.75120800      -0.75910000      -0.00000000
H        0.85026500      -2.50630700      -0.00000000
H        1.49098500       2.40525200       0.00000000
H       -3.23049700       1.76647600      -0.00000000
Cl       1.49098500       5.00525200       0.00000000