%chk=000068856.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068856

0 1
 Cl   3.166200      -3.108100      -3.062800    
 F    1.976300       3.204800     -0.1194000    
 O   -3.250000       1.915000      -1.052100    
 O   -2.416700      0.5065000       1.505600    
 O   -1.547800       3.354000     -0.4448000    
 O   -1.307000      -3.310900       1.715800    
 N   -1.291700      -1.287300      0.5197000    
 N   0.1224000       1.399300     -2.3900000E-02
 N   -3.213500      -2.013300       1.685900    
 C   0.9208000     -0.8471000     -0.6165000    
 C  -0.1722000      -1.685300     -0.3113000    
 C   -1.187100      0.9769000     -0.4843000    
 C    1.075900      0.5298000     -6.1500002E-02
 C   -1.702600      5.7799999E-02  0.6044000    
 C    2.400100      0.9463000      0.4837000    
 C    1.941600      -1.293500      -1.477800    
 C  -0.1758000      -2.979300     -0.8751000    
 C   -1.986300       2.230000     -0.6486000    
 C   -1.895700      -2.297700       1.328000    
 C    1.907900      -2.575500      -2.017800    
 C   0.8511000      -3.420300      -1.712800    
 C    2.782300       2.281000      0.4235000    
 C    3.238400     -8.0000004E-03   1.047800    
 C    4.021200       2.667300      0.9351000    
 C    4.477300      0.3784000       1.559300    
 C    4.868700       1.715900       1.502900    
 C   -4.128100       3.027900      -1.248700    
 C   -3.993600      -2.880200       2.537800    
 C   -5.481800       2.515600      -1.691900    
 H   -1.158200      0.4956000      -1.469000    
 H    2.765100     -0.6332000      -1.744300    
 H   -1.007400      -3.662100     -0.7144000    
 H   0.7986000      -4.422100      -2.131600    
 H    2.953000      -1.051800       1.138600    
 H   -3.681700      -1.216100       1.268000    
 H    4.325400       3.708800      0.8916000    
 H    5.134300     -0.3608000       2.008300    
 H    5.832400       2.017000       1.902700    
 H   -3.712700       3.689500      -2.017100    
 H   -4.231300       3.581600     -0.3088000    
 H   -4.809100      -2.298600       2.973300    
 H   -4.399800      -3.690900       1.927700    
 H   -3.365300      -3.297400       3.328900    
 H   -5.901600       1.837500     -0.9415000    
 H   -5.392100       1.944100      -2.621500    
 H   -6.179900       3.342100      -1.851200    


%chk=000068856-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068856

0 1
Cl 2.890496 -2.910299 -3.494789
F 2.230748 3.173543 -0.213265
O -3.226098 2.037380 -1.448767
O -2.965922 0.334263 1.257455
O -2.121431 3.374215 0.117760
O -1.016288 -3.382418 1.465659
N -1.391062 -1.246708 0.485802
N -0.008158 1.415917 0.156706
N -2.736300 -2.048857 2.319533
C 0.795492 -0.782483 -0.662598
C -0.375401 -1.579066 -0.497285
C -1.325416 1.068102 -0.419235
C 0.962108 0.533533 0.031264
C -1.997657 0.028042 0.503205
C 2.303512 0.869277 0.592473
C 1.795421 -1.210182 -1.579029
C -0.536536 -2.766313 -1.251626
C -2.225270 2.310326 -0.512555
C -1.703471 -2.324777 1.469483
C 1.608097 -2.388415 -2.314088
C 0.448164 -3.177421 -2.167818
C 2.874676 2.164534 0.515556
C 3.053317 -0.123901 1.282651
C 4.109283 2.488103 1.103026
C 4.291329 0.176198 1.886504
C 4.818447 1.486408 1.801221
C -4.277749 3.090904 -1.601156
C -3.119027 -2.991491 3.377492
C -5.286358 2.565156 -2.616507
H -1.248050 0.623574 -1.435075
H 2.697821 -0.607412 -1.712492
H -1.428653 -3.379361 -1.105928
H 0.319992 -4.093377 -2.750746
H 2.640738 -1.135726 1.357794
H -3.203017 -1.130725 2.222087
H 4.497344 3.505849 1.003046
H 4.839090 -0.604550 2.423255
H 5.778582 1.728759 2.268259
H -3.785280 4.022653 -1.933275
H -4.726486 3.270775 -0.607745
H -2.994851 -2.530052 4.374038
H -4.173130 -3.301273 3.258335
H -2.473963 -3.880867 3.311833
H -5.745261 1.625518 -2.264614
H -4.804582 2.375693 -3.591016
H -6.089241 3.310152 -2.764926


