%chk=000127907.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127907

0 1
 O   -6.747200      -2.058900      2.6300000E-02
 O    6.217100     -0.5928000      8.7499999E-02
 N   -1.381300      0.9952000      0.2387000    
 C  -2.3100000E-02  0.8499000     -0.2880000    
 C   -2.231600     -9.4400004E-02 -0.2265000    
 C   0.5774000     -0.4820000      0.1979000    
 C   -1.941800       2.289600     -0.1529000    
 C   -3.630000      2.9200001E-02  0.3762000    
 C  -8.6099997E-02  0.9424000      -1.812700    
 C   -4.535500      -1.108800     -9.1700003E-02
 C    2.086800     -0.5112000      0.1682000    
 C   -1.065600       3.434700      0.3255000    
 C   -5.944800     -0.9726000      0.4695000    
 C    2.734800     -0.9511000     -0.9746000    
 C    2.795400     -9.8200001E-02   1.285000    
 C    4.129200     -0.9788000      -1.001400    
 C    4.189700     -0.1259000       1.258100    
 C    4.856700     -0.5663000      0.1149000    
 H   0.6258000       1.643500      9.7300000E-02
 H   -2.350500     -0.1155000      -1.314900    
 H   -1.848900      -1.071200      8.5500002E-02
 H   0.2098000      -1.331400     -0.3931000    
 H   0.2664000     -0.6839000       1.233200    
 H   -2.192500       2.390100      -1.214000    
 H   -2.879600       2.453700      0.3883000    
 H   -4.127700      0.9536000      6.7299999E-02
 H   -3.572900      3.0400001E-02   1.471800    
 H   0.9388000      0.9418000      -2.204900    
 H  -0.5729000      8.8500001E-02  -2.292900    
 H  -0.5156000       1.866900      -2.204400    
 H   -4.583100      -1.131500      -1.187800    
 H   -4.117000      -2.076900      0.2103000    
 H  -0.7542000       3.304700       1.368000    
 H  -0.1776000       3.575500     -0.2981000    
 H   -1.630100       4.373100      0.2742000    
 H   -5.931600     -0.9880000       1.563700    
 H   -6.416000     -3.9200000E-02  0.1451000    
 H    2.178600      -1.278500      -1.848200    
 H    2.285300      0.2488000       2.179000    
 H    4.636700      -1.324700      -1.897900    
 H    4.750900      0.1976000       2.130500    
 H   -6.768700      -2.029700     -0.9454000    
 H    6.508500     -0.9237000     -0.7795000    


%chk=000127907-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000127907

0 1
O -6.779047 -2.312761 0.111779
O 6.291949 -0.681500 0.036425
N -1.449647 1.155598 -0.093670
C -0.022826 0.911741 -0.470436
C -2.428802 0.192000 -0.655831
C 0.529610 -0.340001 0.281828
C -1.875826 2.572510 -0.235849
C -3.604572 -0.088478 0.308281
C 0.233820 0.830366 -2.000610
C -4.647272 -1.053280 -0.300934
C 2.043816 -0.468014 0.207264
C -1.318125 3.489849 0.870925
C -5.802541 -1.360386 0.668720
C 2.672382 -1.414486 -0.638684
C 2.877910 0.384551 0.981450
C 4.080111 -1.512194 -0.720022
C 4.282362 0.304607 0.914638
C 4.883908 -0.646978 0.058855
H 0.543771 1.779998 -0.081443
H -2.837512 0.533050 -1.640463
H -1.911412 -0.765261 -0.852781
H 0.057985 -1.255297 -0.126360
H 0.198774 -0.244124 1.333161
H -1.607240 2.990520 -1.238491
H -2.980091 2.594166 -0.180267
H -4.097640 0.865562 0.585498
H -3.193362 -0.509895 1.245905
H 1.315429 0.748940 -2.207432
H -0.263026 -0.052635 -2.444679
H -0.143881 1.732356 -2.516911
H -5.058467 -0.612214 -1.235075
H -4.163187 -2.008405 -0.585772
H -1.618337 3.111379 1.863649
H -0.214644 3.545362 0.846759
H -1.704374 4.519513 0.750229
H -5.424400 -1.861652 1.575923
H -6.304602 -0.416959 0.977664
H 2.054205 -2.088888 -1.243655
H 2.417628 1.116691 1.656895
H 4.543565 -2.256734 -1.381064
H 4.923997 0.956837 1.514681
H -7.153349 -1.930961 -0.722363
H 6.614962 -1.380491 -0.584638


