%chk=000045531.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000045531

0 1
 Cl  -7.177000      -1.873300       1.332500    
 O    1.245900      -1.402600      -1.543300    
 O    3.474300      -2.442600     -0.3771000    
 O    4.886100     -0.9715000       1.488900    
 N  -4.3699998E-02   2.608400     -0.6638000    
 C   0.1388000       1.148200     -0.8209000    
 C    1.416100      0.5991000     -0.2066000    
 C   0.2808000       3.057100      0.6958000    
 C   -1.088000      0.4198000     -0.2488000    
 C    1.713500       2.732700       1.125100    
 C    2.137900       1.338000      0.7478000    
 C   -2.363300      0.9361000     -0.8950000    
 C    1.874800     -0.6760000     -0.5743000    
 C   0.6844000       3.365900      -1.682300    
 C    3.305000      0.7980000       1.307000    
 C    3.032300      -1.207100     -6.0000001E-03
 C    3.746700     -0.4706000      0.9346000    
 C   -3.571200      0.2297000     -0.3350000    
 C   -4.024000     -0.9322000     -0.9421000    
 C   -4.211700      0.7536000      0.7783000    
 C    1.700300      -1.221200      -2.881000    
 C   -5.142800      -1.585000     -0.4245000    
 C   -5.330400      0.1007000       1.296000    
 C    2.997800      -3.552900      0.3793000    
 C   -5.796000      -1.068600      0.6946000    
 C    6.113200     -0.6837000      0.8210000    
 H   0.1561000      0.9379000      -1.898000    
 H  -0.4199000       2.595100       1.402600    
 H   0.1040000       4.135800      0.7914000    
 H   -1.138500      0.5303000      0.8426000    
 H   -1.006300     -0.6601000     -0.4276000    
 H    1.791400       2.860700       2.211600    
 H    2.409500       3.441400      0.6595000    
 H   -2.326700      0.7927000      -1.982900    
 H   -2.496400       2.013600     -0.7400000    
 H   0.5147000       4.441100      -1.556900    
 H   0.3142000       3.110200      -2.681500    
 H    1.764000       3.183800      -1.665200    
 H    3.874000       1.374500       2.033200    
 H   -3.521000      -1.343200      -1.812900    
 H   -3.855500       1.662400       1.255000    
 H    2.637300      -1.765300      -3.034300    
 H    1.845700     -0.1628000      -3.120400    
 H   0.9454000      -1.631300      -3.557400    
 H   -5.494100      -2.495500     -0.9032000    
 H   -5.829100      0.5144000       2.168800    
 H    3.431700      -4.464600     -4.0199999E-02
 H    1.907300      -3.623400      0.3153000    
 H    3.307600      -3.467900       1.425600    
 H    6.291800      0.3960000      0.7960000    
 H    6.102100      -1.086600     -0.1967000    
 H    6.925500      -1.160000       1.376700    


%chk=000045531-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000045531

0 1
Cl -7.346834 -1.873537 1.468150
O 1.155306 -1.141369 -1.678293
O 3.539555 -2.326064 -0.575808
O 4.957142 -0.872840 1.483897
N -0.085290 2.771864 -0.543032
C 0.100651 1.316686 -0.804561
C 1.413073 0.765520 -0.220239
C 0.181722 3.113458 0.877202
C -1.122221 0.497132 -0.297922
C 1.640318 2.811556 1.307335
C 2.115270 1.449517 0.809522
C -2.424757 0.881771 -1.049084
C 1.922345 -0.475784 -0.695513
C 0.634191 3.638452 -1.502027
C 3.307987 0.896165 1.334688
C 3.094168 -1.050787 -0.137321
C 3.802670 -0.334435 0.867160
C -3.653466 0.214191 -0.455993
C -4.095261 -1.054790 -0.912687
C -4.370306 0.828783 0.604034
C 1.867753 -1.606946 -2.889774
C -5.213928 -1.698640 -0.336057
C -5.491066 0.204855 1.197113
C 3.324354 -3.393115 0.433636
C -5.894008 -1.054582 0.714282
C 6.104385 -1.105453 0.576842
H 0.132977 1.181189 -1.903854
H -0.516908 2.532629 1.507173
H -0.052703 4.182804 1.033077
H -1.259913 0.653195 0.789402
H -0.906920 -0.576239 -0.444363
H 1.728207 2.863687 2.409678
H 2.315001 3.595158 0.905755
H -2.313023 0.596627 -2.114089
H -2.517977 1.983259 -1.010442
H 0.411479 4.696820 -1.273008
H 0.272292 3.429709 -2.524852
H 1.743686 3.511598 -1.501842
H 3.870837 1.416563 2.117092
H -3.560070 -1.549410 -1.732167
H -4.052936 1.813390 0.968138
H 2.636541 -2.351517 -2.628574
H 2.332799 -0.748578 -3.412138
H 1.086829 -2.053080 -3.524882
H -5.549073 -2.675525 -0.697003
H -6.040315 0.688434 2.010437
H 3.715474 -4.315633 -0.022661
H 2.244921 -3.501877 0.646662
H 3.874636 -3.158166 1.362558
H 6.458711 -0.143711 0.158919
H 5.827219 -1.793583 -0.241218
H 6.889076 -1.550151 1.207955


