%chk=000063490.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000063490

0 1
 Cl  -6.480200      0.9296000      -2.470600    
 O   0.3375000       1.994700       1.550000    
 N    1.048600      8.3999999E-02  0.4002000    
 N   -1.875500     -0.5735000     -0.5166000    
 N   -2.030600      0.6220000       1.350700    
 N    2.885700      0.2342000      -1.113800    
 C   3.3500001E-02 -0.7458000       1.053000    
 C   0.2484000     -0.8186000       2.588900    
 C  -0.7974000      -1.689400       3.324200    
 C   -1.325200     -0.1991000      0.6520000    
 C    1.671000      -1.295400       2.923300    
 C    1.936400     -0.4457000     -0.5486000    
 C    1.102600       1.437800      0.7675000    
 C  -0.8464000      -3.150600       2.898000    
 C   -3.081000      7.5300001E-02 -0.5964000    
 C    2.183600       2.222000      0.1337000    
 C   -3.154500      0.8148000      0.5806000    
 C    1.793800      -1.860400     -0.9401000    
 C    3.033100       1.585000     -0.7741000    
 C   -4.082800      7.8599997E-02  -1.567600    
 C   -4.287600       1.610800      0.8198000    
 C    2.353800       3.576100      0.4438000    
 C    4.061100       2.323900      -1.370900    
 C    2.484300      -2.842400     -0.2379000    
 C   0.9699000      -2.200300      -2.007700    
 C   -5.203300      0.8764000      -1.313400    
 C   -5.305900       1.629700     -0.1416000    
 C    3.382200       4.299400     -0.1585000    
 C    4.235500       3.674400      -1.064800    
 C    2.349400      -4.180500     -0.6079000    
 C   0.8351000      -3.538500      -2.377600    
 C    1.524800      -4.528600      -1.677600    
 H   7.6399997E-02  -1.771500      0.6828000    
 H   0.1479000      0.1792000       3.031700    
 H  -0.5878000      -1.654100       4.401200    
 H   -1.797300      -1.257900       3.204800    
 H    1.811800      -1.338400       4.009200    
 H    1.868900      -2.294100       2.528100    
 H    2.431600     -0.6130000       2.532000    
 H   -1.497100      -1.211500      -1.203600    
 H   -1.589500      -3.685100       3.499400    
 H   0.1145000      -3.650900       3.045400    
 H   -1.139200      -3.257400       1.849900    
 H   -3.988800     -0.5117000      -2.473000    
 H    1.699900       4.081500       1.149100    
 H   -4.376300       2.199600       1.727100    
 H    4.734000       1.850100      -2.081700    
 H    3.144500      -2.581200      0.5837000    
 H   0.4350000      -1.435700      -2.564200    
 H   -6.183700       2.245700      4.2100001E-02
 H    3.518400       5.350400      7.9300001E-02
 H    5.036600       4.237900      -1.534200    
 H    2.889800      -4.950900     -6.5600000E-02
 H   0.1944000      -3.809300      -3.211600    
 H    1.420800      -5.570300      -1.966500    


%chk=000063490-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000063490

0 1
Cl -6.112111 2.266458 -2.643967
O 0.429882 1.943205 1.667135
N 1.047246 0.008358 0.481504
N -1.607882 0.319229 -0.517323
N -2.503242 -0.109763 1.533709
N 2.720119 0.085225 -1.264097
C -0.048095 -0.731483 1.214229
C 0.111357 -0.773691 2.776768
C -0.719584 -1.941967 3.393393
C -1.389507 -0.156844 0.788032
C 1.587831 -0.820275 3.230024
C 1.838817 -0.591457 -0.535536
C 1.178440 1.410355 0.796671
C -0.245711 -3.378360 3.073925
C -2.946658 0.717261 -0.606235
C 2.194585 2.135408 0.017146
C -3.497187 0.433968 0.691300
C 1.681815 -2.042388 -0.885660
C 2.922716 1.448783 -1.003496
C -3.707081 1.278868 -1.651649
C -4.855871 0.715094 0.955484
C 2.427751 3.514758 0.258957
C 3.883265 2.161414 -1.774309
C 1.875430 -3.090633 0.050384
C 1.429244 -2.369696 -2.243767
C -5.053340 1.540939 -1.341659
C -5.638234 1.274379 -0.076070
C 3.380863 4.205946 -0.506365
C 4.108068 3.524946 -1.525236
C 1.796598 -4.438807 -0.360979
C 1.335532 -3.717350 -2.650831
C 1.515843 -4.757444 -1.709310
H 0.006173 -1.767005 0.835099
H -0.326650 0.165066 3.156690
H -0.695189 -1.799964 4.492754
H -1.772704 -1.814573 3.087537
H 1.625086 -0.896156 4.332305
H 2.140236 -1.687480 2.824179
H 2.133180 0.095437 2.945410
H -0.899006 0.405663 -1.243366
H -0.887151 -4.111248 3.597049
H 0.794548 -3.556305 3.405388
H -0.305494 -3.613502 1.994531
H -3.297370 1.503118 -2.639703
H 1.847510 4.010109 1.044058
H -5.285534 0.506128 1.939137
H 4.431836 1.615932 -2.547924
H 2.120922 -2.858921 1.091160
H 1.331104 -1.560602 -2.975020
H -6.693464 1.507642 0.089470
H 3.566280 5.269298 -0.322629
H 4.849887 4.070863 -2.118337
H 1.959163 -5.237102 0.371051
H 1.131754 -3.955396 -3.700349
H 1.448686 -5.804136 -2.025260


