%chk=000051598.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051598

0 1
 Cl  -6.163100       1.153200     -0.9006000    
 O   -1.712500      -1.663800      -1.654700    
 N    3.814100       1.911200      0.1327000    
 N  -0.1486000     -0.6804000     -0.2535000    
 C    2.275400     -0.4172000     -0.7569000    
 C    2.801000     -0.2841000      0.6861000    
 C    1.016600      -1.303600     -0.8395000    
 C    3.064000      -1.668300       1.293000    
 C    2.078400      0.9764000      -1.367300    
 C    4.069800      0.5853000      0.7158000    
 C    1.273300      -2.670600     -0.1929000    
 C    1.822100      -2.555200       1.229700    
 C    3.361400       1.805100      -1.261100    
 C    5.011000       2.747700      0.2195000    
 C   -1.431500     -0.9187000     -0.7196000    
 C   -2.519400     -0.1810000     -2.7300000E-02
 C   -3.679900      9.8499998E-02 -0.7186000    
 C   -2.334500      0.1994000       1.285700    
 C   -4.701700      0.7898000     -6.7400001E-02
 C   -3.356100      0.8906000       1.936800    
 C   -4.539700       1.185700       1.260300    
 H    3.055400     -0.9211000      -1.348300    
 H    2.041200      0.2155000       1.303400    
 H   0.7923000      -1.474500      -1.900600    
 H    3.381300      -1.564700       2.337400    
 H    3.886700      -2.160800      0.7591000    
 H    1.265800       1.510600     -0.8593000    
 H    1.790900      0.8849000      -2.421400    
 H    4.385800      0.7018000       1.760200    
 H    4.887100      7.9000004E-02  0.1844000    
 H    2.000400      -3.220700     -0.8040000    
 H   0.3561000      -3.271400     -0.1796000    
 H    2.066400      -3.554000       1.609000    
 H    1.048100      -2.146700       1.891000    
 H    4.141200       1.358600      -1.892300    
 H    3.153800       2.805500      -1.660400    
 H   1.1100000E-02 -3.0800000E-02  0.5075000    
 H    5.852700       2.325900     -0.3416000    
 H    5.319500       2.871100       1.263600    
 H    4.807200       3.752400     -0.1674000    
 H   -3.806100     -0.2049000      -1.754500    
 H   -1.447400     -4.2900000E-02   1.861200    
 H   -3.234100       1.191300       2.973400    
 H   -5.328200       1.723000       1.781300    


%chk=000051598-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000051598

0 1
Cl -6.328977 1.049539 -0.929862
O -1.662290 -1.559133 -1.741974
N 3.852019 1.896908 0.100076
N -0.121958 -0.671047 -0.243047
C 2.309129 -0.444550 -0.782397
C 2.831727 -0.311996 0.675355
C 1.041767 -1.337170 -0.872247
C 3.083944 -1.707245 1.296749
C 2.129908 0.948857 -1.426839
C 4.100380 0.566421 0.701211
C 1.304529 -2.727352 -0.229132
C 1.825462 -2.604487 1.221286
C 3.424837 1.777861 -1.314868
C 5.001198 2.807277 0.266328
C -1.407698 -0.844062 -0.719564
C -2.505266 -0.119768 0.028134
C -3.719298 0.095805 -0.672060
C -2.387494 0.311811 1.374897
C -4.772210 0.758607 -0.023044
C -3.465560 0.969645 2.007299
C -4.671545 1.207414 1.309499
H 3.096647 -0.984664 -1.354249
H 2.069575 0.220752 1.287106
H 0.764725 -1.485388 -1.933308
H 3.414338 -1.598752 2.349076
H 3.915612 -2.200315 0.749958
H 1.313348 1.501276 -0.924053
H 1.846406 0.841581 -2.492204
H 4.431883 0.711223 1.747609
H 4.925728 0.020970 0.165181
H 2.057645 -3.255570 -0.848906
H 0.375380 -3.324396 -0.268569
H 2.050849 -3.609948 1.624955
H 1.027141 -2.179890 1.864213
H 4.226743 1.299310 -1.940359
H 3.260428 2.795515 -1.715929
H 0.049688 -0.014254 0.518877
H 5.927425 2.453494 -0.254762
H 5.236571 2.918025 1.340252
H 4.746507 3.805664 -0.132293
H -3.805573 -0.270111 -1.699249
H -1.479022 0.108270 1.953533
H -3.376191 1.293487 3.049493
H -5.511158 1.717486 1.790130


