%chk=000157270.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157270

0 1
 Cl  -6.140300     -0.4649000     -0.7141000    
 O    2.478500     -0.6006000       1.431700    
 N   0.6338000       1.158000     -0.1628000    
 N    1.047600       1.862100      0.8815000    
 N   0.4546000       3.177600     -0.8935000    
 C   0.5999000     -0.3118000     -8.3999999E-02
 C    2.016500     -0.9178000      0.1170000    
 C    3.041700     -0.3903000     -0.9055000    
 C    4.477600     -0.9202000     -0.7073000    
 C  -0.3974000     -0.8084000      0.9963000    
 C   -1.843800     -0.7221000      0.5660000    
 C    4.481800      -2.448300     -0.8045000    
 C    5.077000     -0.4873000      0.6313000    
 C   0.2823000       1.915700      -1.211900    
 C   -2.559400      0.4351000      0.8241000    
 C   -2.424300      -1.801700     -7.8400001E-02
 C   0.9203000       3.095500      0.3874000    
 C   -3.893900      0.5150000      0.4266000    
 C   -3.758900      -1.721900     -0.4761000    
 C   -4.493800     -0.5636000     -0.2236000    
 H   0.2490000     -0.6469000      -1.070500    
 H    1.941300      -2.008100      4.3000001E-02
 H    3.103900      0.7031000     -0.8532000    
 H    2.699500     -0.6405000      -1.917500    
 H    5.097200     -0.5116000      -1.515300    
 H  -0.2664000     -0.2656000       1.941600    
 H  -0.1822000      -1.859100       1.234700    
 H    3.995500      -2.785000      -1.726200    
 H    3.982200      -2.925100      4.4500001E-02
 H    5.512700      -2.819500     -0.8215000    
 H    4.752400      -1.107000       1.472000    
 H    4.864100      0.5644000      0.8483000    
 H    6.167900     -0.5914000      0.5880000    
 H    1.947600      -1.110900       2.065600    
 H  -8.0899999E-02   1.535700      -2.156400    
 H   -2.103400       1.279500       1.332500    
 H   -1.859300      -2.706800     -0.2821000    
 H    1.175400       3.961700      0.9795000    
 H   -4.454400       1.423700      0.6305000    
 H   -4.213000      -2.569900     -0.9824000    


%chk=000157270-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157270

0 1
Cl -6.234503 0.112552 -0.758144
O 2.378295 -0.524360 1.631573
N 0.510918 0.929329 -0.227450
N 1.011545 1.742164 0.803271
N 0.048440 3.035366 -0.856341
C 0.624039 -0.545041 -0.128907
C 2.083774 -0.951105 0.259317
C 3.120472 -0.459277 -0.778803
C 4.567068 -1.017244 -0.625934
C -0.416164 -1.118549 0.880278
C -1.854922 -0.823469 0.495035
C 4.599725 -2.564012 -0.563535
C 5.332597 -0.400567 0.570606
C -0.058906 1.724556 -1.194353
C -2.504806 0.353617 0.948740
C -2.575386 -1.707241 -0.350076
C 0.706654 2.995106 0.364167
C -3.834639 0.648162 0.573128
C -3.905788 -1.432003 -0.738393
C -4.514609 -0.252339 -0.268639
H 0.404050 -0.935313 -1.141168
H 2.096820 -2.055844 0.301028
H 3.160363 0.648134 -0.757993
H 2.747292 -0.747906 -1.785546
H 5.101305 -0.713389 -1.552053
H -0.171450 -0.718702 1.879592
H -0.245223 -2.210764 0.922359
H 4.025183 -3.019796 -1.393298
H 4.184032 -2.934989 0.391599
H 5.640141 -2.931016 -0.632895
H 4.839084 -0.656821 1.522950
H 5.367563 0.702902 0.494129
H 6.374843 -0.771662 0.594854
H 2.141124 0.451437 1.681221
H -0.531021 1.337840 -2.093153
H -1.971572 1.046084 1.610408
H -2.100780 -2.632009 -0.701031
H 0.970558 3.881451 0.934330
H -4.329219 1.556653 0.928275
H -4.457998 -2.121135 -1.383849


