%nproc=32 
%mem = 60GB 
%chk=Cl3F_isomer_21_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 
 
Cl3F_isomer_21_0 opt 
 
-1 1
C       -0.33798700      -0.71365100      -0.00000000
C       -0.74555700       0.63681800      -0.00000000
C        0.25278700       1.62465500      -0.00000000
C       -1.31637700      -1.72430000      -0.00000000
C        1.03464500      -1.00701000      -0.00000000
C       -2.11722100       0.94503400      -0.00000000
C        1.57248300       1.33028900      -0.00000000
C       -2.63563100      -1.39598200       0.00000000
C        1.95560000      -0.01371300       0.00000000
C       -3.04106900      -0.05186900       0.00000000
F       -0.12783200       2.89201400       0.00000000
F        1.42500200      -2.26859700       0.00000000
F        3.24086600      -0.30379000       0.00000000
H       -1.00181900      -2.75500200      -0.00000000
H       -2.41804400       1.97993200      -0.00000000
H        2.32109000       2.10478800      -0.00000000
H       -3.38093900      -2.17606000       0.00000000
H       -4.09265600       0.18806400       0.00000000
Cl       2.32109000       2.10478800       2.00000000