%chk=000053371.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000053371

0 1
 Cl   5.245200      0.9553000     -0.1844000    
 O   -4.929200      -2.603000     -0.4846000    
 O   -3.712500      -1.671700       1.190800    
 O    1.432900      -2.801500      0.1931000    
 N    3.297800      -1.368900      3.6100000E-02
 C  -0.6988000       1.400200      1.4800000E-02
 C   0.7424000       1.280900     -3.4299999E-02
 C   -2.890400      0.4953000     -0.4490000    
 C   -1.501100      0.3802000     -0.4965000    
 C    1.340300      2.1900000E-02  2.2100000E-02
 C   -1.285800       2.535600      0.5735000    
 C    2.729800     -9.2799999E-02 -2.2900000E-02
 C    1.533600       2.425000     -0.1357000    
 C   -3.749600     -0.5955000     -0.9934000    
 C   -3.477300       1.630700      0.1098000    
 C   -2.675000       2.650900      0.6210000    
 C    3.521200       1.051300     -0.1244000    
 C    2.923000       2.310200     -0.1809000    
 C   -4.106100      -1.653000      3.2600001E-02
 C    2.641900      -2.600900      0.1382000    
 C    3.617700      -3.750100      0.1739000    
 H   -1.078800     -0.5029000     -0.9694000    
 H   0.6975000     -0.8327000      0.1530000    
 H  -0.7027000       3.340900       1.011800    
 H    1.112000       3.423400     -0.2134000    
 H   -3.242200      -1.089600      -1.830700    
 H   -4.682300     -0.1715000      -1.385200    
 H   -4.558400       1.731000      0.1566000    
 H   -3.132600       3.531100       1.063000    
 H    3.525600       3.211000     -0.2669000    
 H    4.314800      -1.389800     -6.0000003E-04
 H    4.193400      -3.774700     -0.7557000    
 H    3.075600      -4.693600      0.2816000    
 H    4.297900      -3.633500       1.022400    
 H   -5.159200      -3.287600      0.1793000    


%chk=000053371-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000053371

0 1
Cl 5.394450 0.939803 -0.198133
O -4.418171 -2.573000 0.304937
O -5.808413 -0.716890 0.414864
O 1.673338 -2.903960 0.036158
N 3.467524 -1.385748 -0.000758
C -0.736186 1.363811 0.031150
C 0.751607 1.257461 -0.024246
C -2.972212 0.429012 -0.462233
C -1.563058 0.338078 -0.504038
C 1.380975 -0.013037 0.017886
C -1.364835 2.493671 0.619975
C 2.793305 -0.140050 -0.041080
C 1.558816 2.423086 -0.124636
C -3.828832 -0.682604 -1.075902
C -3.579607 1.566396 0.128894
C -2.771501 2.590591 0.666981
C 3.561327 1.053425 -0.132467
C 2.964112 2.320951 -0.174279
C -4.796625 -1.276104 -0.063271
C 2.917870 -2.671260 0.033484
C 3.948509 -3.796505 0.071914
H -1.099360 -0.534526 -0.978621
H 0.799190 -0.931008 0.120758
H -0.754627 3.283187 1.072517
H 1.095077 3.411568 -0.196195
H -3.191524 -1.484128 -1.478949
H -4.438945 -0.268961 -1.900681
H -4.671897 1.635270 0.177532
H -3.239789 3.463691 1.134550
H 3.588000 3.215013 -0.258505
H 4.489899 -1.318582 -0.013458
H 4.994475 -3.447719 0.023401
H 3.760737 -4.481830 -0.772130
H 3.810226 -4.377036 1.000518
H -5.053256 -2.920467 0.989663


