%chk=000100587.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100587

0 1
 Cl  -1.507900      -3.134600      0.6203000    
 O  -0.4760000      0.1020000      -1.852600    
 O   -2.868100     -0.5318000     -0.2117000    
 O   -1.318900       3.119200       1.517900    
 N    1.200300      0.7084000     -0.4007000    
 N  -0.9666000       1.627800     -0.1785000    
 N  -0.4618000       2.400700      0.9925000    
 C    2.203800     -0.1333000      -1.013600    
 C    2.185700      -1.541500     -0.4095000    
 C    3.595000      0.5000000     -0.9049000    
 C    2.736900      -1.573400       1.016000    
 C    4.143800      0.4647000      0.5213000    
 C    4.126200     -0.9482000       1.096600    
 C  -0.1072000      0.7670000     -0.8790000    
 C   -2.362500       1.787000     -0.5665000    
 C   -3.256700      0.7884000      0.1455000    
 C   -3.678500      -1.505700      0.4316000    
 C   -3.187700      -2.896700      7.5199999E-02
 H    1.957100     -0.2179000      -2.079200    
 H    1.169700      -1.950100     -0.4169000    
 H    2.796300      -2.204200      -1.036200    
 H    3.569600       1.537700      -1.258700    
 H    4.286400     -4.3200001E-02  -1.561700    
 H    2.054700      -1.038900       1.688300    
 H    2.780000      -2.610200       1.368500    
 H    5.171100      0.8469000      0.5251000    
 H    3.560100       1.131400       1.166700    
 H    4.460900     -0.9260000       2.139800    
 H    4.839300      -1.574300      0.5462000    
 H    1.451300       1.195000      0.4517000    
 H   -2.695100       2.815200     -0.3889000    
 H   -2.430400       1.614900      -1.647500    
 H   -3.179100      0.9125000       1.231900    
 H   -4.297900      0.9547000     -0.1537000    
 H   -3.645000      -1.361600       1.518300    
 H   -4.716100      -1.390900      9.7900003E-02
 H   -3.808200      -3.665400      0.5437000    
 H   -3.190500      -3.043800      -1.008700    


%chk=000100587-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000100587

0 1
Cl -1.287991 -2.970752 1.118498
O -0.367698 0.568272 -2.242075
O -2.919705 -0.480681 -0.210643
O -1.392525 2.801928 1.651701
N 1.156433 0.672820 -0.456236
N -0.990139 1.661784 -0.244969
N -0.520455 2.160312 0.958694
C 2.229631 -0.126151 -1.091666
C 2.211846 -1.590996 -0.570482
C 3.609518 0.533856 -0.842037
C 2.655896 -1.689090 0.908236
C 4.061414 0.430816 0.636318
C 4.043282 -1.038190 1.127103
C -0.036941 0.908478 -1.074714
C -2.390238 1.822422 -0.683956
C -3.344189 0.890657 0.080175
C -3.629603 -1.487398 0.570010
C -2.984222 -2.834812 0.295752
H 2.005247 -0.126227 -2.173195
H 1.199313 -2.014471 -0.701858
H 2.904107 -2.184628 -1.201998
H 3.582099 1.589515 -1.172304
H 4.351015 0.011537 -1.478959
H 1.904215 -1.191789 1.555146
H 2.676998 -2.750580 1.219794
H 5.075383 0.860838 0.745008
H 3.399346 1.043390 1.284669
H 4.326054 -1.087073 2.196313
H 4.807383 -1.615268 0.565620
H 1.268619 1.026072 0.498345
H -2.692719 2.871298 -0.515188
H -2.404540 1.583928 -1.758852
H -3.307056 1.091266 1.170439
H -4.381838 1.068310 -0.279280
H -3.602594 -1.247444 1.654702
H -4.698342 -1.540903 0.252669
H -3.577571 -3.660884 0.715390
H -2.805433 -2.978363 -0.779667


