%chk=000028868.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000028868

0 1
 Cl  0.6273000      -4.291300       1.075900    
 O  -5.9300002E-02   1.606000      0.2893000    
 O   -5.380400      0.8462000      -2.118900    
 O   -3.673700      -1.377700       1.764500    
 O   -5.781400     -0.8225000      5.5599999E-02
 O  -0.3129000       1.694000      -1.997000    
 N    2.229400       1.501200     -0.6576000    
 N    2.133800       1.314700       2.338100    
 N    2.193400       3.614100       1.935100    
 C    1.237300       2.172700      0.1824000    
 C    1.994200     -0.5421000      0.6849000    
 C    2.565700      0.2783000     -0.4195000    
 C    1.796100      1.7000000E-03   1.965600    
 C    1.879000       2.329900       1.559700    
 C    3.597600     -0.3299000      -1.307300    
 C    1.619800      -1.867000      0.4103000    
 C    1.260600     -0.8259000       2.964600    
 C    1.078400      -2.665800       1.415400    
 C   -2.065500      0.8246000     -0.6342000    
 C    3.698700      8.6099997E-02  -2.629800    
 C    4.449000      -1.307000     -0.8042000    
 C   0.9034000      -2.147500       2.693800    
 C  -0.7279000       1.419400     -0.8817000    
 C   -2.236500     -2.3000001E-03  0.4570000    
 C   -3.096900       1.118900      -1.502400    
 C   -4.354200      0.5619000      -1.269000    
 C   -3.493800     -0.5595000      0.6903000    
 C   -4.552700     -0.2773000     -0.1728000    
 C    4.664200     -0.4826000      -3.460600    
 C    5.414500      -1.875800      -1.634900    
 C    2.816700       3.909100       3.185800    
 C    5.522100      -1.463600      -2.963000    
 C   -6.180300       1.986100      -1.810500    
 C   -3.446200      -2.771200       1.563100    
 C   -6.319700      -1.656000     -0.9683000    
 H    1.102400       3.180700     -0.2306000    
 H    1.729400      -2.276100     -0.5917000    
 H    1.111400     -0.4373000       3.970000    
 H    1.994400       4.395400       1.317100    
 H    3.035700      0.8418000      -3.042200    
 H    4.416100      -1.628600      0.2326000    
 H   0.4852000      -2.757000       3.490500    
 H   -1.422700     -0.2415000       1.134400    
 H   -2.948000       1.774300      -2.356100    
 H    4.747100     -0.1631000      -4.495300    
 H    6.087600      -2.634200      -1.245800    
 H    2.976000       4.987800       3.279100    
 H    3.792700       3.419900       3.265700    
 H    2.189200       3.591000       4.024600    
 H    6.274700      -1.905300      -3.609500    
 H   -6.654600       1.871400     -0.8307000    
 H   -5.573000       2.896600      -1.830000    
 H   -6.962500       2.070900      -2.569700    
 H   -2.420100      -2.948300       1.226600    
 H   -4.155000      -3.175500      0.8340000    
 H   -3.594600      -3.284200       2.517100    
 H   -6.897300      -2.450300     -0.4861000    
 H   -7.000400      -1.080400      -1.601600    
 H   -5.537400      -2.124500      -1.575800    


%chk=000028868-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000028868

0 1
Cl 0.527109 -4.241426 1.522979
O 0.135574 1.692768 0.225953
O -5.497237 1.075920 -2.011326
O -3.127382 -1.771222 1.311623
O -5.535820 -1.218062 -0.285201
O -0.785228 3.134748 -1.376655
N 2.419508 1.514822 -0.686409
N 2.100639 1.545020 2.366781
N 2.488557 3.782239 1.800108
C 1.483828 2.334696 0.069801
C 2.019104 -0.455080 0.813393
C 2.629477 0.245923 -0.350069
C 1.775024 0.215783 2.069578
C 2.035029 2.525681 1.486767
C 3.580016 -0.498011 -1.238658
C 1.662182 -1.830374 0.683207
C 1.219412 -0.539138 3.146872
C 1.061148 -2.506402 1.748490
C -2.093194 1.259483 -0.511478
C 3.690920 -0.124229 -2.605882
C 4.418500 -1.532061 -0.739168
C 0.839712 -1.880367 2.996176
C -0.894454 2.133243 -0.628640
C -2.105365 0.132600 0.341209
C -3.231846 1.572205 -1.297218
C -4.364470 0.748161 -1.224154
C -3.235528 -0.713829 0.403174
C -4.382180 -0.416269 -0.395150
C 4.607186 -0.776308 -3.455101
C 5.342044 -2.178081 -1.589241
C 3.134813 4.082111 3.082530
C 5.436554 -1.806971 -2.950424
C -6.645970 1.587071 -1.226237
C -3.767916 -3.068890 1.025749
C -5.987126 -1.873404 -1.539497
H 1.330625 3.284303 -0.472019
H 1.827128 -2.340583 -0.269752
H 1.071374 -0.020509 4.098391
H 2.357394 4.526435 1.116587
H 3.050618 0.681870 -2.976626
H 4.364460 -1.813455 0.317656
H 0.376679 -2.429434 3.820771
H -1.234828 -0.119368 0.950194
H -3.231989 2.448271 -1.951482
H 4.675522 -0.485168 -4.509177
H 5.989230 -2.966175 -1.188878
H 3.451328 5.137702 3.091013
H 4.016070 3.433626 3.232954
H 2.440941 3.898558 3.922765
H 6.149056 -2.313932 -3.610915
H -6.982607 0.837333 -0.486912
H -6.366584 2.525385 -0.711027
H -7.440002 1.785824 -1.962012
H -3.538461 -3.402758 -0.004629
H -4.858412 -3.012276 1.167849
H -3.310266 -3.763872 1.746168
H -6.929785 -2.378346 -1.279720
H -6.148359 -1.124734 -2.333189
H -5.235652 -2.617647 -1.865593


