%chk=000051989.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000051989

0 1
 Cl  0.7145000      -5.593700       1.295800    
 O   -4.265000      -1.927000      -2.061200    
 O    4.518600      -1.943200       1.520700    
 O    4.295600       4.056000     -0.6566000    
 N   -4.260600      0.8652000      0.9087000    
 N    3.487400      -1.263700      0.8703000    
 N   0.4668000      0.8024000      -1.076700    
 C   -4.636100       1.774400     -0.1831000    
 C   -5.282900      0.8522000       1.964600    
 C   -4.824900       3.203100      0.3289000    
 C   -5.492600       2.250900       2.547000    
 C   -5.847500       3.257100       1.458300    
 C   -4.038100     -0.4862000      0.3953000    
 C   -2.947300     -0.5335000     -0.6232000    
 C   -1.756500      0.1510000     -0.3796000    
 C   -3.108400      -1.252800      -1.807400    
 C  -0.7311000      0.1140000      -1.321100    
 C    1.384700      0.1258000     -0.4620000    
 C    2.684600      0.7974000     -0.1711000    
 C    1.204100      -1.295400     -3.0999999E-02
 C   -2.079000      -1.287300      -2.748100    
 C    3.699500      8.3999999E-02  0.4863000    
 C  -0.8883000     -0.6028000      -2.504400    
 C    2.267200      -1.947300      0.6244000    
 C    2.888100       2.132000     -0.5541000    
 C   4.0000002E-03  -1.983600     -0.2665000    
 C    4.915700      0.7383000      0.7489000    
 C    2.095000      -3.284100       1.029200    
 C    4.101800       2.761400     -0.2839000    
 C    5.114800       2.065800      0.3667000    
 C  -0.1444000      -3.309100      0.1435000    
 C   0.8990000      -3.959200      0.7904000    
 C    5.561500       4.637900     -0.3488000    
 H   -5.563100       1.436800     -0.6665000    
 H   -3.870300       1.825600     -0.9639000    
 H   -4.967600      0.1882000       2.778600    
 H   -6.237300      0.4677000       1.581300    
 H   -5.149800       3.851400     -0.4929000    
 H   -3.864200       3.595700      0.6857000    
 H   -4.578900       2.575600       3.060800    
 H   -6.289400       2.223400       3.298800    
 H   -5.890600       4.267600       1.879100    
 H   -6.844300       3.030100       1.060800    
 H   -4.977700     -0.8883000     -3.7000000E-03
 H   -3.739700      -1.150600       1.217300    
 H   -1.612200      0.7081000      0.5435000    
 H   -2.190900      -1.843200      -3.675000    
 H  -9.3599997E-02 -0.6325000      -3.245400    
 H    2.111600       2.697000      -1.063800    
 H  -0.9318000      -1.828200     -0.6970000    
 H    5.727600      0.2223000       1.256100    
 H    2.901800      -3.808400       1.537600    
 H   -4.193400      -2.365600      -2.926300    
 H    6.082500       2.491900      0.6085000    
 H   -1.079800      -3.833700     -4.4399999E-02
 H    5.003000      -2.333800      0.7729000    
 H    5.729700       4.687100      0.7324000    
 H    5.541100       5.669100     -0.7162000    
 H    6.377000       4.128000     -0.8731000    


%chk=000051989-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000051989

0 1
Cl 2.266502 -6.292454 1.452145
O -4.671124 -1.777222 -2.479323
O 5.296061 -2.042057 0.631361
O 3.340105 4.073498 -0.049454
N -4.613556 1.222925 0.527868
N 3.999643 -1.514165 0.269908
N 0.281621 0.173686 -0.558683
C -4.514247 2.433132 -0.329715
C -5.713370 1.347922 1.516682
C -4.265460 3.695219 0.520784
C -5.503360 2.575520 2.426489
C -5.373666 3.865866 1.584590
C -4.717718 -0.020652 -0.269690
C -3.400885 -0.439938 -0.915333
C -2.157342 0.019346 -0.434682
C -3.407183 -1.332696 -2.019996
C -0.925103 -0.407642 -1.004235
C 1.386438 -0.419444 -0.149759
C 2.583470 0.454975 0.019622
C 1.579731 -1.852132 0.222452
C -2.197589 -1.745261 -2.624728
C 3.880710 -0.107104 0.236839
C -0.962256 -1.293439 -2.120021
C 2.904382 -2.371005 0.440242
C 2.465056 1.859163 -0.072493
C 0.491299 -2.742316 0.442055
C 5.013110 0.729600 0.369404
C 3.115159 -3.727708 0.807238
C 3.591001 2.695653 0.058501
C 4.874261 2.127752 0.284990
C 0.677716 -4.084875 0.812435
C 1.999440 -4.553234 0.975972
C 4.481629 4.980555 0.080945
H -5.454638 2.570363 -0.928543
H -3.688050 2.285437 -1.047983
H -5.740728 0.424702 2.126186
H -6.710045 1.440113 1.006249
H -4.219115 4.581174 -0.141519
H -3.282191 3.599356 1.020872
H -4.578199 2.425183 3.016080
H -6.347857 2.654745 3.138321
H -5.157642 4.733923 2.236071
H -6.339952 4.072800 1.078752
H -5.500919 0.047812 -1.063021
H -5.049780 -0.832160 0.409387
H -2.157958 0.719783 0.406264
H -2.215730 -2.419299 -3.491986
H -0.026557 -1.609214 -2.592878
H 1.474833 2.283268 -0.257480
H -0.527796 -2.371523 0.319204
H 5.989843 0.284115 0.570254
H 4.126067 -4.092430 0.992689
H -4.563547 -2.357634 -3.272902
H 5.760934 2.757256 0.402978
H -0.175743 -4.747632 0.973813
H 5.725672 -2.279647 -0.238090
H 4.957248 4.892470 1.077599
H 4.060263 5.989361 -0.038691
H 5.237010 4.797513 -0.708638


