%chk=000054748.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054748

0 1
 Cl   6.419600     -0.8056000      0.5457000    
 O   -3.334800      0.4176000     -0.3831000    
 O   -2.438100      -1.973800       1.112600    
 O   -2.395800      -1.948600      -1.935600    
 O   -1.808800       1.637000      -1.727300    
 O   -4.268700       1.733100       1.832000    
 O    1.670600      -1.616900      0.7903000    
 O    3.338700       2.484100     -0.4638000    
 N   0.3441000     -0.1286000     -0.3539000    
 N    2.571700      0.4322000      0.1901000    
 N    2.349600       1.743700     -0.4840000    
 C  -0.8137000     -0.9949000     -0.3796000    
 C   -1.651900     -0.8023000      0.8916000    
 C   -1.628500     -0.7745000      -1.663800    
 C   -2.542800      0.4444000      0.8082000    
 C   -2.563100      0.4369000      -1.586700    
 C   -3.501100      0.5553000       1.989300    
 C    1.537500     -0.5152000      0.2476000    
 C    3.879100      0.1650000      0.7762000    
 C    4.836300     -0.4891000     -0.2059000    
 H  -0.4522000      -2.032100     -0.3906000    
 H  -0.9971000     -0.7153000       1.766800    
 H  -0.9435000     -0.6547000      -2.511900    
 H   -1.921700       1.348900      0.7811000    
 H   -3.276200      0.3921000      -2.417900    
 H   0.2291000      0.8129000     -0.7116000    
 H   -4.205600     -0.2816000       2.016200    
 H   -2.967200      0.5990000       2.943500    
 H   -3.201100      -1.945100      0.5128000    
 H   -3.226800      -1.894100      -1.435900    
 H   -2.403700       2.306800      -2.104600    
 H   -3.657400       2.489200       1.847300    
 H    3.733500     -0.5081000       1.630600    
 H    4.299100       1.088800       1.191000    
 H    4.441400      -1.445000     -0.5641000    
 H    5.006900      0.1509000      -1.077100    


%chk=000054748-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054748

0 1
Cl 6.464958 -0.643410 0.501724
O -3.263587 0.594534 -0.448767
O -2.705104 -1.980421 1.141691
O -2.599863 -2.079702 -1.599361
O -1.424817 1.432133 -1.785147
O -4.018953 2.075656 2.083117
O 1.750463 -1.598288 0.846283
O 3.088460 2.576658 -0.562923
N 0.284624 -0.168684 -0.301838
N 2.509037 0.521308 0.171218
N 2.151378 1.714386 -0.473828
C -0.855249 -1.097401 -0.275677
C -1.784391 -0.862819 0.961185
C -1.660528 -0.945711 -1.588611
C -2.522646 0.492335 0.848148
C -2.447064 0.389434 -1.618772
C -3.565983 0.685622 1.954556
C 1.479958 -0.508355 0.270078
C 3.852588 0.282454 0.745040
C 4.764915 -0.416802 -0.276428
H -0.473779 -2.131088 -0.208147
H -1.155053 -0.849154 1.869654
H -0.983029 -0.984007 -2.463133
H -1.768671 1.308535 0.881178
H -3.170098 0.415332 -2.458055
H 0.164667 0.744823 -0.765548
H -4.468244 0.106795 1.710780
H -3.154026 0.301188 2.910814
H -3.048827 -2.234832 0.238464
H -3.178533 -2.050597 -2.401365
H -1.860983 2.319803 -1.831003
H -3.279166 2.627636 2.442941
H 3.730689 -0.350877 1.636732
H 4.273133 1.263924 1.022138
H 4.406551 -1.426481 -0.521487
H 4.924574 0.188474 -1.180150


