%chk=000054590.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000054590

0 1
 Cl   4.816600      -1.922600     -0.3823000    
 O  -0.5290000      0.8605000      0.5792000    
 O   0.5359000     -0.8900000       1.599900    
 O    2.745900       2.149700      -1.048700    
 N    1.747400      0.5880000      0.2830000    
 N    1.660300       1.805900     -0.5687000    
 C   -1.773000      0.1693000      0.5446000    
 C   -2.898900       1.154800      0.2336000    
 C   -1.707100     -0.9541000     -0.4890000    
 C   -4.241400      0.4458000      8.9199997E-02
 C   -3.049600      -1.663300     -0.6335000    
 C   -4.175000     -0.6784000     -0.9419000    
 C   0.5818000      0.1056000      0.8794000    
 C    3.036400     -6.0800001E-02  0.4674000    
 C    3.249600      -1.110400     -0.6122000    
 H   -1.961600     -0.2557000       1.539800    
 H   -2.956000       1.913600       1.023300    
 H   -2.664300       1.703000     -0.6881000    
 H   -1.398700     -0.5423000      -1.459200    
 H  -0.9479000      -1.700100     -0.2317000    
 H   -5.011200       1.168800     -0.2027000    
 H   -4.542200      3.2699998E-02   1.059800    
 H   -3.279800      -2.201600      0.2942000    
 H   -2.987800      -2.412400      -1.431000    
 H   -5.132800      -1.210100     -0.9697000    
 H   -4.019000     -0.2485000      -1.939100    
 H    3.038800     -0.5448000       1.451800    
 H    3.840100      0.6840000      0.4809000    
 H    2.468700      -1.876900     -0.5841000    
 H    3.250400     -0.6636000      -1.611200    


%chk=000054590-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000054590

0 1
Cl 5.360910 -1.569430 0.499920
O -0.442953 0.602361 -0.072414
O 0.673909 -1.100180 1.095739
O 2.940494 2.249516 -1.080925
N 1.876277 0.626402 0.072459
N 1.802330 1.753058 -0.814786
C -1.780689 -0.057230 0.198831
C -2.810579 1.077673 0.195586
C -2.058558 -1.112090 -0.884662
C -4.236729 0.496963 0.376387
C -3.485728 -1.690892 -0.702844
C -4.552060 -0.569339 -0.700350
C 0.660759 -0.045771 0.413660
C 3.161716 0.129944 0.620474
C 3.713881 -1.023058 -0.233120
H -1.713878 -0.540122 1.192830
H -2.575372 1.801802 0.996747
H -2.743220 1.617928 -0.768353
H -1.974729 -0.629651 -1.878094
H -1.304594 -1.918577 -0.831321
H -4.975431 1.319002 0.335512
H -4.325081 0.037878 1.382540
H -3.537786 -2.250082 0.253855
H -3.691091 -2.420325 -1.508521
H -5.556380 -1.000238 -0.526537
H -4.576825 -0.085388 -1.698216
H 2.990376 -0.212052 1.652540
H 3.866606 0.978669 0.613197
H 3.061532 -1.906757 -0.201271
H 3.929493 -0.713914 -1.265866


