%chk=000039962.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039962

0 1
 Cl  -3.853700      -2.268800     -0.3342000    
 O  -0.6342000      0.6464000     -0.3176000    
 O    6.020500       1.339400      0.1784000    
 O    4.020300       1.616600       1.207100    
 N   -1.167000      -1.381500      0.5430000    
 C    4.251200     -0.1869000     -0.4241000    
 C    2.830600     -0.5578000     -0.1482000    
 C   0.5249000     -5.4000001E-02 -0.1420000    
 C    1.818100      0.3665000     -0.4273000    
 C   0.1950000      -1.294000      0.3849000    
 C    2.541100      -1.820300      0.3841000    
 C    1.221800      -2.208700      0.6589000    
 C    4.538600      0.1162000      -1.907700    
 C   -1.597200     -0.2152000      0.1143000    
 C   -2.942000      0.2855000      3.8300000E-02
 C    4.723400       1.006600      0.4119000    
 C   -4.041400     -0.5579000     -0.1615000    
 C   -3.150000       1.663300      0.1691000    
 C   -5.330900     -3.0300001E-02 -0.2299000    
 C   -4.439400       2.190800      0.1010000    
 C   -5.529800       1.344100     -9.8600000E-02
 H    4.898500      -1.023500     -0.1269000    
 H    2.013000       1.349000     -0.8397000    
 H    3.341100      -2.526700      0.5951000    
 H    1.008700      -3.189400       1.071200    
 H    4.176600     -0.6969000      -2.546600    
 H    4.053500       1.043500      -2.232700    
 H    5.613100      0.2279000      -2.089400    
 H   -2.324300       2.351600      0.3356000    
 H   -6.191800     -0.6756000     -0.3852000    
 H   -4.595100       3.260600      0.2055000    
 H   -6.533800       1.755200     -0.1512000    
 H    6.303200       2.107800      0.7187000    


%chk=000039962-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039962

0 1
Cl -4.059809 -2.315005 0.718260
O -0.603391 0.721564 -0.261712
O 5.477545 0.697355 1.493135
O 4.485555 2.288765 0.126129
N -1.125899 -1.472522 0.305202
C 4.398449 -0.109010 -0.517848
C 2.936400 -0.504869 -0.257909
C 0.600325 -0.004290 -0.189418
C 1.901231 0.455676 -0.405901
C 0.276913 -1.347193 0.158511
C 2.632062 -1.853876 0.095919
C 1.308475 -2.296256 0.306073
C 4.647821 0.225768 -2.012207
C -1.623809 -0.266754 0.059510
C -2.994355 0.242651 0.055206
C 4.768255 1.090963 0.351959
C -4.150214 -0.544765 0.327207
C -3.201450 1.625819 -0.240596
C -5.443271 0.016095 0.305555
C -4.487611 2.190903 -0.263696
C -5.616919 1.384671 0.010426
H 5.046148 -0.947360 -0.210955
H 2.120476 1.496789 -0.659939
H 3.457606 -2.565368 0.209798
H 1.082717 -3.331034 0.576712
H 4.348351 -0.628573 -2.642973
H 4.062610 1.110257 -2.315043
H 5.715568 0.441890 -2.195360
H -2.323219 2.241378 -0.450876
H -6.304539 -0.622858 0.519900
H -4.610368 3.253936 -0.493587
H -6.625084 1.811386 -0.003806
H 5.666033 1.497367 2.056626


