%chk=000029336.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000029336

0 1
 Cl   3.308700       1.714200       1.161300    
 O   -4.993600      -1.424800       1.610600    
 O   -6.459100      -1.912300      -1.531800    
 O   -8.547200      -1.269100     -0.9311000    
 O   -6.386200       3.649000     -0.9084000    
 O   -6.222900       2.643200       1.120300    
 N    1.140800     -0.7654000      1.4000000E-03
 N   -5.226700     -4.3299999E-02 -0.2370000    
 N    7.409300     -0.7969000     -0.8220000    
 N    7.548700       1.572300     -0.4043000    
 N    5.795100       2.774700      0.4697000    
 N    9.370100      0.4008000      -1.297300    
 C    3.487500     -0.8649000      0.5894000    
 C    2.078400     -0.9740000       1.081000    
 C   -6.666800      6.7000002E-02 -0.1832000    
 C    5.518100      0.3593000      9.3599997E-02
 C    4.195500      0.3328000      0.5687000    
 C  -0.2343000     -0.7704000      0.1668000    
 C    6.144700     -0.8108000     -0.3654000    
 C    4.097200      -2.029900      0.1376000    
 C   -3.029400     -0.7835000      0.5021000    
 C   -7.139200       1.401200     -0.7674000    
 C    5.412900      -1.995400     -0.3336000    
 C   -1.094500     -0.5619000     -0.9278000    
 C  -0.8094000     -0.9856000       1.433600    
 C   -4.473500     -0.7916000      0.6750000    
 C   -2.479500     -0.5684000     -0.7617000    
 C   -2.194400     -0.9921000       1.599700    
 C    6.281000       1.522700      4.6300001E-02
 C   -7.335600      -1.088600     -0.9089000    
 C    8.042500      0.3938000     -0.8168000    
 C   -6.538300       2.598000     -6.0400002E-02
 H    1.930700      -1.980600       1.497100    
 H    1.891100     -0.2984000       1.922500    
 H   -6.963300     -1.0400000E-02  0.8701000    
 H    1.497300     -0.6087000     -0.9355000    
 H    3.566100      -2.978500      0.1396000    
 H   -8.229800       1.490100     -0.7080000    
 H   -6.861100       1.449000      -1.828300    
 H    5.867000      -2.921000     -0.6824000    
 H   -4.761200      0.4703000     -0.9774000    
 H  -0.6822000     -0.4003000      -1.921500    
 H  -0.1990000      -1.155100       2.316400    
 H   -3.090600     -0.4357000      -1.649400    
 H   -2.603200      -1.158000       2.593100    
 H    5.584300       2.820300       1.462700    
 H    5.021800       3.126400     -8.8000000E-02
 H    9.786900     -0.4620000      -1.618400    
 H    9.888400       1.268400      -1.313200    
 H   -6.912600      -2.651000      -1.991000    
 H   -5.998000       4.429000     -0.4574000    


%chk=000029336-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000029336

0 1
Cl 3.323221 1.503317 1.430764
O -4.990610 -0.541089 1.903162
O -6.659359 -2.351927 -0.803922
O -8.758959 -1.376077 -0.655166
O -6.856661 3.521766 -1.270869
O -6.932820 2.759869 0.922532
N 1.178985 -0.718304 -0.101072
N -5.322839 -0.056217 -0.345539
N 7.574447 -0.777309 -0.932932
N 7.750940 1.529965 -0.154894
N 6.075981 2.683320 0.904792
N 9.535029 0.465833 -1.214509
C 3.558289 -1.066398 0.442370
C 2.120957 -1.259714 0.893007
C -6.768115 0.010329 -0.177718
C 5.625293 0.321445 0.184421
C 4.274111 0.132250 0.607364
C -0.192104 -0.628264 0.102672
C 6.276158 -0.814380 -0.467071
C 4.237713 -2.151938 -0.196647
C -3.029363 -0.425964 0.474853
C -7.401501 1.200518 -0.938318
C 5.550955 -2.035111 -0.640057
C -1.021123 -0.010989 -0.886173
C -0.813368 -1.134477 1.286679
C -4.494607 -0.352019 0.746976
C -2.407672 0.084915 -0.699593
C -2.201497 -1.024141 1.460196
C 6.478826 1.513785 0.313300
C -7.514879 -1.277561 -0.565662
C 8.241470 0.391033 -0.756387
C -7.039112 2.526325 -0.298366
H 1.938365 -2.344293 1.042692
H 1.952116 -0.763406 1.869860
H -6.936158 0.143139 0.912185
H 1.575099 -0.331079 -0.957186
H 3.693111 -3.093373 -0.331575
H -8.502404 1.090517 -0.901670
H -7.108121 1.211422 -2.001906
H 6.073341 -2.861652 -1.128240
H -4.949385 -0.143717 -1.291100
H -0.560606 0.405358 -1.790816
H -0.211554 -1.611956 2.065681
H -2.996095 0.605730 -1.465043
H -2.682344 -1.398319 2.370266
H 5.146391 2.805221 1.299810
H 6.763373 3.435187 0.932520
H 9.946055 -0.347561 -1.664188
H 10.057411 1.328444 -1.091102
H -7.202885 -3.165608 -0.989820
H -6.660994 4.387052 -0.817560


