%chk=000067426.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000067426

0 1
 O   -2.415600      4.0100001E-02   2.190400    
 O    3.299300     -0.1294000     -0.3320000    
 O    1.881200      -2.482300      2.3100000E-02
 O    2.013100       2.305000     -3.0600000E-02
 N   -3.096700      5.1199999E-02 -4.6900000E-02
 C   -2.754800      4.6399999E-02  -1.473600    
 C   -4.504300      7.5000003E-02  0.2691000    
 C   -2.147700      3.5300002E-02  0.9894000    
 C   -3.269500       1.312700      -2.145600    
 C   -3.306400      -1.201600      -2.151500    
 C   -4.851200       1.338700       1.045500    
 C   -4.899400      -1.175500       1.044700    
 C  -0.7186000     -7.7000000E-03  0.6413000    
 C  -2.4400000E-02   1.179700      0.4682000    
 C  -9.1399997E-02  -1.235300      0.4944000    
 C    1.263800      -1.276500      0.1665000    
 C    1.330800       1.138400      0.1400000    
 C    1.974800     -8.9599997E-02 -1.0800000E-02
 C    4.227300     -0.1427000      0.7503000    
 C    1.876800      -3.061700      -1.280100    
 C    2.038300       2.854600      -1.346500    
 C    5.609500     -0.2443000      0.1958000    
 C    6.565000      0.6694000      0.3989000    
 H   -1.670400      3.0700000E-02  -1.603500    
 H   -5.106300      8.6099997E-02 -0.6436000    
 H   -2.908700       1.365400      -3.179000    
 H   -4.361300       1.369700      -2.185600    
 H   -2.907000       2.205000      -1.623300    
 H   -2.969000      -2.106200      -1.633400    
 H   -2.948900      -1.259600      -3.185700    
 H   -4.399500      -1.226700      -2.188800    
 H   -5.938100       1.424000       1.158300    
 H   -4.427300       1.359700       2.053400    
 H   -4.503300       2.234200      0.5194000    
 H   -4.587300      -2.082700      0.5161000    
 H   -5.988500      -1.218300       1.159900    
 H   -4.473500      -1.214400       2.051100    
 H  -0.5259000       2.136900      0.5858000    
 H  -0.6451000      -2.160400      0.6327000    
 H    4.037200      -1.011100       1.392100    
 H    4.104200      0.7656000       1.352200    
 H    2.407400      -4.016600      -1.232300    
 H   0.8510000      -3.247200      -1.613900    
 H    2.392200      -2.410300      -1.992900    
 H    1.023600       3.089300      -1.683500    
 H    2.515300       2.159800      -2.045000    
 H    2.621200       3.779300      -1.320400    
 H    5.844000      -1.119700     -0.4040000    
 H    7.552000      0.5365000     -3.0400001E-02
 H    6.382700       1.559500      0.9910000    


%chk=000067426-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000067426

0 1
O -2.449539 0.932428 1.936866
O 3.342976 -0.226667 -0.480653
O 1.489305 -2.430697 -0.794489
O 2.290817 2.311877 0.401737
N -3.292361 0.026971 -0.047411
C -3.124971 -0.256928 -1.508856
C -4.696113 0.043631 0.493883
C -2.247236 0.434861 0.777937
C -3.856292 0.793118 -2.381879
C -3.557120 -1.697779 -1.871646
C -5.192241 1.472116 0.827703
C -4.847673 -0.921364 1.692658
C -0.815660 0.262997 0.309663
C 0.070744 1.352314 0.482483
C -0.315578 -0.973527 -0.164855
C 1.060534 -1.136987 -0.442388
C 1.437041 1.207907 0.175241
C 1.957032 -0.047674 -0.255195
C 4.167073 -0.174441 0.778955
C 2.301367 -2.558826 -2.024441
C 3.016606 2.805052 -0.792418
C 5.596260 -0.426140 0.387445
C 6.628042 0.384479 0.729168
H -2.047087 -0.161656 -1.718331
H -5.324498 -0.347074 -0.328720
H -3.647538 0.597503 -3.449703
H -4.952010 0.755730 -2.243506
H -3.510081 1.813920 -2.142324
H -3.014082 -2.442063 -1.263109
H -3.342935 -1.898737 -2.937135
H -4.640292 -1.852323 -1.714705
H -6.256464 1.433564 1.126902
H -4.603033 1.896050 1.655302
H -5.104232 2.139531 -0.047905
H -4.531019 -1.943595 1.417106
H -5.906609 -0.959150 2.008267
H -4.239004 -0.578585 2.544232
H -0.290445 2.306718 0.875041
H -0.964349 -1.846492 -0.283791
H 3.786500 -0.968888 1.452107
H 4.032558 0.811080 1.261044
H 2.546776 -3.629644 -2.093315
H 1.705938 -2.253637 -2.907041
H 3.218401 -1.950917 -1.957385
H 2.295434 3.163852 -1.551279
H 3.657347 2.014592 -1.221777
H 3.628576 3.645906 -0.432198
H 5.778710 -1.344307 -0.188296
H 7.661574 0.141756 0.458660
H 6.469450 1.308550 1.299051


