%chk=000005863.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005863

0 1
 Cl   2.691100       3.686900       1.482400    
 F   -1.695000     -0.4127000       1.209900    
 F   -4.593000       2.561600     -4.3699998E-02
 O    2.431200      0.8308000       1.700200    
 O  -0.4141000      -1.816600      -1.857500    
 O    4.583200       1.583500     -0.6488000    
 O    5.566000     -0.8509000      0.1927000    
 O   -6.370300      -1.621900       1.798200    
 O    5.330900      -3.145500      0.3222000    
 C    1.265000      0.4833000     -0.4505000    
 C   0.1134000       1.400100      2.4100000E-02
 C   -1.251400       1.042500     -0.5865000    
 C   -1.625100     -0.4235000     -0.1766000    
 C    2.444200       1.155700      0.3141000    
 C   0.9169000     -0.9579000     -2.4400000E-02
 C   0.6661000       2.813300     -0.1720000    
 C  -0.4778000      -1.431500     -0.4934000    
 C   -3.071800     -0.8327000     -0.6629000    
 C    2.180400       2.673100      0.1078000    
 C   -2.323400       2.039500     -0.1143000    
 C    1.526600      0.5550000      -1.979600    
 C   -3.721500       1.657000     -0.5787000    
 C   -4.046200      0.2436000     -0.1633000    
 C    3.811400      0.7585000     -0.1622000    
 C   -3.223400     -0.9316000      -2.197700    
 C   -3.437300      -2.204800     -0.1151000    
 C   -5.099400     -1.8400000E-02  0.6267000    
 C    4.176500     -0.7026000     -8.8999998E-03
 C   -4.483600      -2.469100      0.6732000    
 C   -5.397500      -1.389800       1.088400    
 C    6.021500      -2.135800      0.3460000    
 C    7.506200      -2.139100      0.5499000    
 H   6.0000003E-04   1.277600       1.113900    
 H   -1.192200       1.112400      -1.677700    
 H   0.9342000      -1.031800       1.070000    
 H    1.671400      -1.656800     -0.3991000    
 H   0.5040000       3.152800      -1.202000    
 H   0.1700000       3.531600      0.4890000    
 H  -0.6788000      -2.351600      6.8899997E-02
 H    2.710100       3.073200     -0.7635000    
 H   -2.097600       3.046600     -0.4850000    
 H   -2.315700       2.118800      0.9812000    
 H    2.286100     -0.1727000      -2.283500    
 H   0.6309000      0.3338000      -2.565000    
 H    1.874500       1.538300      -2.309800    
 H   -3.803500       1.757500      -1.665600    
 H   -2.740000      -1.825500      -2.606300    
 H   -4.280200     -0.9949000      -2.488900    
 H   -2.797800     -6.8300001E-02  -2.718000    
 H   -2.812500      -3.045700     -0.4083000    
 H    3.041200       1.435300       2.156400    
 H   0.2749000      -2.496800      -1.945300    
 H   -5.766400      0.7639000      0.9725000    
 H    3.882000      -1.226700     -0.9231000    
 H    3.657500      -1.130300      0.8536000    
 H   -4.691700      -3.475900       1.016100    
 H    7.756700      -1.577900       1.453600    
 H    8.000400      -1.704900     -0.3227000    
 H    7.853800      -3.169000      0.6714000    


%chk=000005863-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005863

0 1
Cl 2.728011 3.968096 1.575134
F -1.821455 -0.277553 1.316809
F -4.675755 2.464283 -0.356465
O 2.204962 1.073156 2.099456
O -0.190767 -1.984661 -1.487258
O 4.558730 1.178134 -0.616531
O 5.585269 -1.019823 0.762003
O -6.441670 -1.871337 1.354504
O 4.062992 -2.068310 -0.651081
C 1.348778 0.491502 -0.144058
C 0.157531 1.469687 0.109443
C -1.137621 1.033353 -0.602642
C -1.521304 -0.403339 -0.142837
C 2.476771 1.265850 0.671775
C 0.971252 -0.883072 0.450144
C 0.740520 2.870661 -0.200921
C -0.355664 -1.440474 -0.122927
C -2.883151 -0.901549 -0.787314
C 2.237065 2.737903 0.191100
C -2.289148 2.027664 -0.294406
C 1.754363 0.379635 -1.638704
C -3.642272 1.544938 -0.840715
C -3.954219 0.127824 -0.408760
C 3.898514 0.766685 0.368252
C -2.805188 -0.994301 -2.356425
C -3.223161 -2.296985 -0.294541
C -5.091596 -0.196174 0.268963
C 4.453925 -0.277892 1.349611
C -4.366294 -2.608623 0.374948
C -5.377323 -1.577852 0.717190
C 5.250039 -1.881619 -0.288437
C 6.484343 -2.503182 -0.890123
H -0.045125 1.427419 1.198034
H -0.963898 0.998977 -1.695851
H 0.857155 -0.776612 1.543505
H 1.769972 -1.629069 0.263843
H 0.661057 3.119810 -1.275850
H 0.242376 3.674080 0.364385
H -0.686528 -2.260523 0.546889
H 2.942444 2.992233 -0.612415
H -2.058917 3.018627 -0.724279
H -2.388011 2.141290 0.800254
H 2.570489 -0.353196 -1.757681
H 0.904562 0.026715 -2.242883
H 2.112215 1.334730 -2.060008
H -3.675641 1.634675 -1.945223
H -2.079892 -1.764204 -2.654846
H -3.805708 -1.256256 -2.742019
H -2.499304 -0.040715 -2.820465
H -2.505916 -3.079957 -0.573407
H 2.392137 1.933826 2.568380
H 0.701924 -2.410627 -1.544044
H -5.834416 0.569306 0.514363
H 3.655888 -0.962763 1.678945
H 4.876594 0.223138 2.236039
H -4.593963 -3.635661 0.682795
H 7.240350 -2.705539 -0.115486
H 6.926560 -1.791945 -1.611648
H 6.218817 -3.427383 -1.424016


