%nproc=32 
%mem = 60GB 
%chk=Cl5F_isomer_62_1.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_62_1 opt 
 
-1 1
C        0.67018600      -0.52803000       0.00000100
C       -0.11758100       0.65297600       0.00000000
C       -1.51908400       0.53387300       0.00000000
C        2.07242900      -0.39225500       0.00000000
C        0.00030000      -1.76644000       0.00000100
C        0.55386500       1.89161400       0.00000100
C       -2.10411400      -0.68969700      -0.00000000
C        2.67909700       0.81592800      -0.00000000
C       -1.34910000      -1.85918000       0.00000000
C        1.90298900       1.97904400      -0.00000000
F       -2.28637700       1.60129800      -0.00000000
F        2.82105100      -1.47867500      -0.00000100
F        0.70160800      -2.88092800       0.00000000
F       -0.15571100       3.00504200      -0.00000000
F       -3.41566100      -0.78288700      -0.00000000
H        3.75541600       0.86441700      -0.00000100
H       -1.83673800      -2.81961800      -0.00000100
H        2.36321900       2.95356000      -0.00000000
Cl       3.05931750       3.81797700       2.00000100