%nproc=32 
%mem = 60GB 
%chk=Cl3F_isomer_27_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 
 
Cl3F_isomer_27_1 opt 
 
-1 1
C       -0.42040100      -0.26528000       0.00000000
C        0.58558500       0.72933500       0.00000000
C        0.23802500       2.09138500       0.00000000
C       -0.01903300      -1.61559500      -0.00000000
C        1.92643100       0.30888400      -0.00000000
C       -1.75664200       0.17844100       0.00000100
C       -1.06935600       2.45919300      -0.00000000
C        1.28486400      -1.97655800      -0.00000000
C        2.28381200      -0.99352200      -0.00000000
C       -2.08330500       1.49291500       0.00000000
F       -0.94037600      -2.56251400       0.00000000
F        2.86314800       1.24730400      -0.00000000
F       -2.72780600      -0.71484500      -0.00000100
H        1.02317000       2.82837800      -0.00000000
H       -1.33833300       3.50359800      -0.00000000
H        1.53830200      -3.02395000       0.00000000
H        3.32731200      -1.26265500      -0.00000000
H       -3.12503000       1.76994000      -0.00000000
Cl       2.43280700      -2.14330250       2.00000100