%chk=000173301.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000173301

0 1
 Cl -0.4429000      -2.264800       2.254600    
 F    3.984000      -1.164900     -0.4527000    
 F    5.641100     -0.1410000      0.5291000    
 F    4.553800      0.8407000      -1.092600    
 O    2.173700      0.7731000      0.3630000    
 O   -4.050400     -0.1998000       1.243100    
 O    1.295900       1.637700       2.322900    
 O   -3.642600      -1.460700     -0.6551000    
 N   -1.585600       2.550300     -0.9779000    
 C  -0.9953000      0.1901000      0.4740000    
 C  -3.7500001E-02   1.383400      0.3800000    
 C   -2.362400      0.4710000     -0.1576000    
 C  -0.3732000      -1.017100     -0.1674000    
 C  -0.3582000       2.484200     -0.3375000    
 C   -2.588200       1.600700     -0.8655000    
 C    1.207800       1.291300       1.159400    
 C   0.5220000       3.690300     -0.5254000    
 C   -3.873300       1.948300      -1.567100    
 C   -3.419200     -0.5237000      8.8900000E-02
 C  -9.2299998E-02  -2.164200      0.5675000    
 C  -8.1699997E-02 -0.9597000      -1.526700    
 C   0.4863000      -3.265700     -6.3000001E-02
 C   0.4968000      -2.061100      -2.157400    
 C   0.7807000      -3.214200      -1.425500    
 C    3.454300      0.6200000      0.9834000    
 C   -5.112600      -1.081400       1.621800    
 C    4.419300      3.7400000E-02 -1.6300000E-02
 H   -1.188500      5.8200002E-02   1.543900    
 H   -1.789800       3.386200      -1.514200    
 H   2.6699999E-02   4.584300     -0.1317000    
 H   0.7240000       3.848200      -1.590400    
 H    1.486800       3.597800     -1.8900000E-02
 H   -3.691100       2.097800      -2.636700    
 H   -4.290400       2.873500      -1.155300    
 H   -4.636200       1.170500      -1.470500    
 H  -0.2899000     -7.6600000E-02  -2.123800    
 H   0.7140000      -4.171500      0.4930000    
 H   0.7268000      -2.021100      -3.218000    
 H    1.231600      -4.071500      -1.916600    
 H    3.363800     -5.0700001E-02   1.845000    
 H    3.815800       1.597400       1.321300    
 H   -5.539300     -0.7162000       2.559700    
 H   -4.726200      -2.092600       1.781800    
 H   -5.894900      -1.082600      0.8567000    


%chk=000173301-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000173301

0 1
Cl -0.764738 -2.673303 2.161704
F 4.537471 0.419243 -0.255546
F 5.885253 1.250461 1.379524
F 4.849356 2.654695 -0.075395
O 2.286863 1.817831 0.899761
O -3.378003 -0.935448 1.394047
O 1.377289 -0.121026 1.851566
O -4.857056 0.259268 0.061532
N -1.244605 2.279916 -1.379884
C -1.072858 0.064376 0.409933
C 0.073779 1.077441 0.207578
C -2.416680 0.639218 -0.080555
C -0.756190 -1.268098 -0.306372
C -0.019027 2.090674 -0.737219
C -2.453916 1.667060 -1.002648
C 1.246176 0.828654 1.041108
C 1.054421 3.067778 -1.170585
C -3.667567 2.282255 -1.662987
C -3.667094 0.020096 0.414395
C -0.595554 -2.513025 0.349248
C -0.604950 -1.272022 -1.720497
C -0.295059 -3.702009 -0.349027
C -0.306928 -2.445296 -2.441642
C -0.149307 -3.669048 -1.752063
C 3.510137 1.552649 1.654324
C -4.537137 -1.648036 1.968935
C 4.674843 1.467384 0.675909
H -1.151613 -0.161245 1.486192
H -1.299263 3.019735 -2.081646
H 0.725845 3.637996 -2.059372
H 1.997280 2.553235 -1.408753
H 1.289551 3.781590 -0.363435
H -3.502412 2.382096 -2.753721
H -3.859815 3.294385 -1.256712
H -4.559751 1.669185 -1.482751
H -0.726770 -0.326217 -2.260216
H -0.175217 -4.638630 0.203503
H -0.197164 -2.407681 -3.530823
H 0.085314 -4.591180 -2.294369
H 3.421040 0.603272 2.213040
H 3.690723 2.390793 2.347176
H -4.094649 -2.366924 2.672321
H -5.102934 -2.162301 1.173930
H -5.205582 -0.938497 2.485792


