%chk=000040326.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000040326

0 1
 Cl   3.419000       3.798700      0.1519000    
 Cl   3.223000       2.037800      -2.209100    
 O   0.4460000      -1.914500      0.5696000    
 O    1.925900      -3.409800       1.530400    
 O   -3.803300      0.7756000      0.2365000    
 C    3.588600      -1.165600     -0.2066000    
 C    2.480900     -0.1646000     -5.6600001E-02
 C    2.670700      -1.233500      0.9717000    
 C    4.985700     -0.6758000     -2.3100000E-02
 C    3.474000      -2.253200      -1.222500    
 C    2.776500       1.210800      0.3158000    
 C    1.654900      -2.313400       1.061800    
 C    3.101400       2.227600     -0.4970000    
 C  -0.5907000      -2.887300      0.6151000    
 C   -1.840600      -2.306100      4.6000000E-02
 C   -2.242200      -1.021400      0.4120000    
 C   -2.607900      -3.047200     -0.8527000    
 C   -3.411100     -0.4778000     -0.1207000    
 C   -3.776900      -2.503600      -1.385300    
 C   -4.178500      -1.218900      -1.019300    
 C   -2.839600       1.769800      0.2585000    
 C   -1.948200       1.867600     -0.7946000    
 C   -2.793100       2.639400       1.333100    
 C  -0.9775000       2.869100     -0.7725000    
 C   -1.822400       3.640800       1.355200    
 C  -0.9146000       3.755700      0.3024000    
 H    1.653000     -0.2495000     -0.7539000    
 H    3.087600     -0.9530000       1.934800    
 H    5.329600     -0.1339000     -0.9105000    
 H    5.105300     -2.0099999E-02  0.8463000    
 H    5.665600      -1.521500      0.1314000    
 H    3.991300      -1.968900      -2.145800    
 H    3.931000      -3.177600     -0.8529000    
 H    2.437400      -2.473700      -1.499200    
 H    2.709600       1.428000       1.381600    
 H  -0.2752000      -3.766500      4.0500000E-02
 H  -0.7749000      -3.188900       1.653300    
 H   -1.653600     -0.4652000       1.137900    
 H   -2.308400      -4.049800      -1.146100    
 H   -4.374600      -3.080600      -2.084800    
 H   -5.089800     -0.8006000      -1.437800    
 H   -1.990500       1.204500      -1.653700    
 H   -3.498800       2.550800       2.153500    
 H  -0.2733000       2.961400      -1.594100    
 H   -1.773100       4.331000       2.192400    
 H  -0.1590000       4.535500      0.3193000    


%chk=000040326-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000040326

0 1
Cl 2.864372 3.724613 -2.048715
Cl 1.051605 1.481175 -2.981108
O 0.793176 -2.297279 0.040396
O 1.079545 -1.702477 2.285698
O -3.672956 0.755574 0.362770
C 3.736877 -1.330293 -0.360069
C 2.703643 -0.286957 -0.830380
C 2.631887 -0.851560 0.629280
C 5.159668 -0.884533 -0.019779
C 3.668753 -2.720656 -0.987415
C 3.030717 1.141301 -1.030303
C 1.458874 -1.642435 1.090097
C 2.409470 1.978450 -1.892766
C -0.438353 -3.079354 0.404416
C -1.673553 -2.389466 -0.130842
C -2.039344 -1.113863 0.366558
C -2.479279 -3.021661 -1.108878
C -3.199076 -0.482223 -0.131700
C -3.652264 -2.386629 -1.579127
C -4.017103 -1.113117 -1.097449
C -2.770626 1.781951 0.756138
C -1.577792 2.058968 0.048587
C -3.186939 2.591033 1.835073
C -0.789825 3.162774 0.444816
C -2.389676 3.692227 2.217424
C -1.188283 3.980832 1.527998
H 1.922095 -0.686159 -1.484330
H 2.990006 -0.191516 1.425892
H 5.765642 -0.791395 -0.940428
H 5.194194 0.083815 0.509425
H 5.644532 -1.633473 0.632584
H 4.263203 -2.737657 -1.919933
H 4.092672 -3.477510 -0.300754
H 2.634391 -3.012791 -1.226115
H 3.836437 1.578053 -0.426990
H -0.294240 -4.067700 -0.060706
H -0.456411 -3.171643 1.505312
H -1.433391 -0.629588 1.139981
H -2.193541 -4.005401 -1.498886
H -4.278606 -2.879736 -2.330143
H -4.915312 -0.597950 -1.450032
H -1.274862 1.439691 -0.801642
H -4.121112 2.350241 2.351151
H 0.130722 3.387451 -0.105159
H -2.707780 4.322516 3.055168
H -0.572962 4.835956 1.827083


