%nproc=32 
%mem = 60GB 
%chk=Cl4F_isomer_37_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 
 
Cl4F_isomer_37_1 opt 
 
-1 1
C        0.08205400       0.27347200      -0.00000000
C       -0.32809500      -1.08109900      -0.00000000
C       -1.69874600      -1.40012000      -0.00000000
C        1.45965400       0.55740000      -0.00000100
C        0.65058300      -2.09205600      -0.00000000
C       -0.92644700       1.25739100       0.00000100
C       -2.60772200      -0.40098200      -0.00000100
C        2.37092400      -0.44849500      -0.00000000
C       -2.24380800       0.94658400       0.00000000
C        1.97226600      -1.78393000       0.00000000
F        1.88742300       1.79981700       0.00000000
F       -0.58300700       2.52895700      -0.00000000
F       -3.89969800      -0.68028000       0.00000100
F        3.65745900      -0.15887400       0.00000000
H       -2.02097300      -2.42851100      -0.00000000
H        0.33373400      -3.12285900      -0.00000000
H       -2.99123200       1.72205900       0.00000000
H        2.73490000      -2.54626000       0.00000100
Cl       1.53431700      -2.83455950       2.00000100