%chk=000055417.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000055417

0 1
 Cl   9.275900      0.7325000     -4.6500001E-02
 O   -3.961700      0.7088000     -0.5970000    
 N   0.6037000     -0.6290000      0.3326000    
 N    3.419800     -0.2478000      4.3800000E-02
 N   -9.327800     -0.1636000      0.5739000    
 C    1.128900      0.2881000     -0.6860000    
 C    1.527700      -1.755400      0.5145000    
 C    2.494500      0.8439000     -0.2746000    
 C    2.905800      -1.267300      0.9671000    
 C  -0.7240000      -1.111100     -4.6399999E-02
 C   -1.700200      5.6100000E-02 -0.1542000    
 C    4.799800     -1.6700000E-02  2.1400001E-02
 C   -3.098500     -0.4176000     -0.5267000    
 C    5.327500       1.254900      0.3219000    
 C    5.703200      -1.049000     -0.3009000    
 C    6.703100       1.485100      0.3006000    
 C    7.078800     -0.8189000     -0.3220000    
 C    7.578800      0.4482000     -2.1400001E-02
 C   -5.284300      0.4936000     -0.3080000    
 C   -5.853800     -0.7456000     -0.5756000    
 C   -6.042000       1.517600      0.2485000    
 C   -7.200000     -0.9641000     -0.2827000    
 C   -7.388000       1.299000      0.5417000    
 C   -7.967100      5.8100000E-02  0.2762000    
 H   0.4982000       1.170000     -0.8211000    
 H    1.212400     -0.2146000      -1.658900    
 H    1.629300      -2.328700     -0.4169000    
 H    1.139800      -2.439900       1.278800    
 H    2.881100       1.448100      -1.105000    
 H    2.379200       1.500400      0.5977000    
 H    2.842900     -0.8404000       1.976400    
 H    3.573000      -2.135100       1.024200    
 H  -0.6911000      -1.662900     -0.9950000    
 H   -1.093100      -1.804100      0.7200000    
 H   -1.742200      0.6150000      0.7897000    
 H   -1.416700      0.7778000     -0.9261000    
 H   -3.425300      -1.130200      0.2418000    
 H   -3.079300     -0.9172000      -1.502400    
 H    4.677100       2.083700      0.5900000    
 H    5.336000      -2.041800     -0.5513000    
 H    7.078900       2.476600      0.5400000    
 H    7.749300      -1.635600     -0.5772000    
 H   -5.299900      -1.557900      -1.035900    
 H   -5.594600       2.485400      0.4568000    
 H   -7.641700      -1.933400     -0.4997000    
 H   -7.975100       2.103600      0.9772000    
 H   -9.748500      -1.062600      0.3798000    
 H   -9.885000      0.5777000      0.9773000    


%chk=000055417-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000055417

0 1
Cl 9.560522 0.787729 -0.222436
O -4.052997 0.630185 0.235333
N 0.699484 -0.680178 0.246785
N 3.561606 -0.254463 -0.015436
N -9.676287 -0.012522 -0.060209
C 1.234635 0.430666 -0.575343
C 1.638408 -1.826087 0.185361
C 2.618023 0.879390 -0.071420
C 3.018326 -1.417777 0.724436
C -0.682103 -1.075488 -0.123100
C -1.724699 0.018858 0.186777
C 4.954540 -0.005894 -0.023286
C -3.153188 -0.509134 0.023309
C 5.480491 1.323812 -0.038010
C 5.896070 -1.082419 -0.059972
C 6.869068 1.565161 -0.106020
C 7.282785 -0.845612 -0.117613
C 7.759902 0.479199 -0.144383
C -5.442769 0.382854 0.144097
C -6.024969 -0.872649 -0.151601
C -6.280354 1.501332 0.370718
C -7.430607 -1.001977 -0.219104
C -7.678191 1.371399 0.302948
C -8.282084 0.113317 0.005978
H 0.550547 1.294561 -0.516300
H 1.320073 0.129744 -1.652015
H 1.752918 -2.209412 -0.861547
H 1.239731 -2.646928 0.810298
H 3.003975 1.636613 -0.775554
H 2.503481 1.358265 0.928571
H 2.918580 -1.169009 1.805369
H 3.701995 -2.275967 0.636945
H -0.752218 -1.362733 -1.206063
H -0.927351 -1.982794 0.464894
H -1.577525 0.375899 1.221926
H -1.604466 0.888241 -0.485302
H -3.369939 -1.305618 0.767671
H -3.308317 -0.929729 -0.994676
H 4.814610 2.187823 0.027908
H 5.553279 -2.120944 -0.073085
H 7.246815 2.592126 -0.112666
H 7.981777 -1.686777 -0.153868
H -5.404822 -1.756255 -0.331584
H -5.816391 2.466167 0.599102
H -7.868467 -1.981315 -0.448913
H -8.311238 2.249377 0.481417
H -10.109460 -0.905606 -0.271907
H -10.278399 0.788267 0.101973


