%chk=000131685.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000131685

0 1
 O   0.7348000       1.024400      -1.469300    
 O   -2.385600      -1.339400      0.5829000    
 O   3.4000000E-03   2.404100      -3.157300    
 O   -3.631200     -0.6941000      -1.235700    
 O   -2.760300       2.424100       1.587400    
 O  -0.4991000       2.591000       1.633700    
 N   -1.655800      0.3813000     -0.6649000    
 C    2.992000      0.4454000     -0.9429000    
 C    2.763000      0.7672000      0.5270000    
 C    2.706800      -1.049200     -0.9762000    
 C    2.409200     -0.4019000       1.237800    
 C    2.374700      -1.516300      0.3156000    
 C    2.077200       1.238800      -1.867400    
 C    2.879700       1.990200       1.167300    
 C    2.758800      -1.910100      -2.060500    
 C    2.159900     -0.3508000       2.599700    
 C    2.082000      -2.853700      0.5282000    
 C   -1.635400       1.359100      -1.724500    
 C    2.628200       2.041300       2.539600    
 C    2.463900      -3.257600      -1.845800    
 C    2.271000      0.8824000       3.248700    
 C    2.128000      -3.724700     -0.5643000    
 C  -0.2248000       1.669900      -2.201400    
 C   -2.401500       2.629400      -1.322100    
 C   -3.341700      -2.367200      0.8656000    
 C   -1.710000       3.499800     -0.2644000    
 C   -2.651300     -0.5626000     -0.5095000    
 C   -4.697300      -1.712200       1.126700    
 C   -2.859200      -3.115900       2.106000    
 C   -3.413900      -3.308200     -0.3362000    
 C   -1.565300       2.815500       1.076200    
 H    4.047300      0.6129000      -1.189300    
 H    2.308800       2.308800      -1.799400    
 H    2.209700      0.9177000      -2.907600    
 H    3.158200       2.886700      0.6245000    
 H    3.021900      -1.554700      -3.050700    
 H    1.884400      -1.237300       3.161200    
 H    1.822100      -3.229700       1.512100    
 H   -2.147300      0.9039000      -2.582000    
 H    2.709400       2.988000       3.067100    
 H    2.495300      -3.955000      -2.678600    
 H    2.079500      0.9468000       4.316600    
 H    1.902100      -4.778200     -0.4214000    
 H   -2.536600       3.250000      -2.217400    
 H   -3.407500       2.358500     -0.9781000    
 H  -0.8927000      0.3774000      5.5999998E-03
 H   -2.284400       4.419500     -0.1038000    
 H  -0.7150000       3.809300     -0.6023000    
 H   -4.592400     -0.8479000       1.793000    
 H   -5.215300      -1.364500      0.2294000    
 H   -5.380300      -2.424100       1.605400    
 H   -2.760200      -2.432900       2.957500    
 H   -1.865000      -3.545700       1.937400    
 H   -3.542800      -3.923500       2.387400    
 H   -3.983400      -2.920500      -1.184500    
 H   -3.906000      -4.247600     -5.6800000E-02
 H   -2.410500      -3.552300     -0.7042000    
 H   -2.656600       1.957600       2.444100    


%chk=000131685-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000131685

0 1
O 0.736175 0.954549 -1.437654
O -2.527935 -0.950202 0.968944
O 0.084110 2.243840 -3.265817
O -3.805032 -0.488725 -0.985816
O -2.979245 2.910915 1.085697
O -0.672569 3.123027 0.933515
N -1.653281 0.364186 -0.649063
C 3.026413 0.519601 -0.704510
C 2.534374 0.301976 0.730700
C 3.193110 -0.913290 -1.218426
C 2.488891 -1.093939 1.024142
C 2.897084 -1.844647 -0.179510
C 2.139788 1.430076 -1.565645
C 2.146906 1.249702 1.691953
C 3.599613 -1.358320 -2.486973
C 2.081375 -1.544884 2.298546
C 3.011944 -3.232830 -0.410635
C -1.629140 1.085323 -1.925795
C 1.731882 0.795805 2.969491
C 3.709260 -2.752868 -2.721349
C 1.706973 -0.588381 3.271362
C 3.419352 -3.679964 -1.689625
C -0.201844 1.491015 -2.307737
C -2.562470 2.335799 -1.930940
C -3.575409 -1.854301 1.601371
C -2.073380 3.529162 -1.065559
C -2.759432 -0.373373 -0.285693
C -4.857600 -1.039859 1.867838
C -2.882570 -2.267881 2.911475
C -3.828348 -3.070417 0.687490
C -1.796863 3.173034 0.381256
H 4.022116 1.015217 -0.683682
H 2.164377 2.476074 -1.209301
H 2.431210 1.410725 -2.630696
H 2.137495 2.321213 1.465972
H 3.830936 -0.648398 -3.290377
H 2.047861 -2.614820 2.533159
H 2.788848 -3.956284 0.381629
H -2.010249 0.413965 -2.722942
H 1.419571 1.523841 3.725886
H 4.021585 -3.117178 -3.706292
H 1.384561 -0.919915 4.264979
H 3.511113 -4.753914 -1.887182
H -2.654278 2.691237 -2.972533
H -3.556275 1.995105 -1.595156
H -0.801748 0.317127 -0.084328
H -2.857606 4.307109 -1.088242
H -1.149043 3.956497 -1.488614
H -4.629986 -0.152474 2.485661
H -5.315781 -0.709541 0.922464
H -5.584997 -1.665004 2.417741
H -2.655215 -1.380710 3.527576
H -1.935330 -2.792681 2.697815
H -3.540092 -2.941706 3.489522
H -4.300947 -2.760041 -0.257554
H -4.496861 -3.785022 1.202047
H -2.878373 -3.587014 0.462571
H -2.752125 2.625660 2.012044


