%chk=000096205.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000096205

0 1
 O   -2.161200      -2.876900      0.9179000    
 O    2.161100       2.876900      0.9179000    
 O   -3.466600     -0.6344000     -8.1400000E-02
 O    3.466500      0.6345000     -8.1400000E-02
 N    0.000000       0.000000      4.4199999E-02
 C  -0.6953000     -0.9780000      0.8698000    
 C   0.6953000      0.9781000      0.8698000    
 C   -1.483900      -1.984500      2.8400000E-02
 C    1.483900       1.984400      2.8400000E-02
 C   -2.518400      -1.330200     -0.8847000    
 C    2.518400       1.330200     -0.8848000    
 C   -4.448600      1.0300000E-02 -0.8792000    
 C    4.448600     -1.0400000E-02 -0.8793000    
 C   -5.407600      0.7181000      1.9200001E-02
 C    5.407600     -0.7181000      1.9200001E-02
 C   -5.626100       2.037400     -1.2000000E-02
 C    5.626100      -2.037400     -1.2000000E-02
 H   -1.379100     -0.4758000       1.566600    
 H   2.1500001E-02  -1.526700       1.494900    
 H    1.373500      0.4773000       1.573300    
 H  -2.3700001E-02   1.532200       1.486900    
 H  -0.7977000      -2.582800     -0.5828000    
 H   0.7948000       2.584700     -0.5764000    
 H   0.6596000     -0.4911000     -0.5566000    
 H   -3.048300      -2.110100      -1.444900    
 H   -2.045000     -0.6456000      -1.597100    
 H    2.056900      0.6567000      -1.614000    
 H    3.051800       2.115600      -1.434300    
 H   -1.485400      -3.319000       1.459700    
 H    2.808800       2.356400       1.423700    
 H   -4.995200     -0.7363000      -1.466600    
 H   -3.962200      0.7096000      -1.569700    
 H    4.995100      0.7362000      -1.466900    
 H    3.962000     -0.7098000      -1.569500    
 H   -5.959900      0.1152000      0.7352000    
 H    5.959900     -0.1151000      0.7352000    
 H   -6.339100       2.492000      0.6671000    
 H   -5.102800       2.683400     -0.7083000    
 H    6.339000      -2.492000      0.6671000    
 H    5.102900      -2.683400     -0.7082000    


%chk=000096205-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000096205

0 1
O -2.408683 -3.205337 0.697095
O 1.847903 2.876522 0.898417
O -3.288662 -0.482669 -0.112940
O 3.249205 0.492570 -0.115192
N 0.201710 -0.491045 0.393430
C -0.829439 -1.306316 1.061734
C 0.655263 0.720721 1.107863
C -1.561273 -2.200198 0.032979
C 1.221860 1.784717 0.132027
C -2.465604 -1.399861 -0.905235
C 2.213261 1.209567 -0.885566
C -4.244266 0.260643 -0.945411
C 4.395513 0.084417 -0.948142
C -5.116753 1.079373 -0.029199
C 5.434354 -0.527379 -0.044966
C -5.392220 2.395024 -0.203367
C 6.038998 -1.719536 -0.268970
H -1.574302 -0.635421 1.521819
H -0.416731 -1.962434 1.872733
H 1.434605 0.506668 1.875375
H -0.207320 1.169686 1.629914
H -0.800720 -2.718287 -0.597196
H 0.394414 2.263186 -0.418825
H 1.009513 -1.056890 0.098679
H -3.109387 -2.106149 -1.472769
H -1.828298 -0.827269 -1.612892
H 1.703711 0.516451 -1.586398
H 2.673824 2.041074 -1.459944
H -1.937080 -3.541418 1.501456
H 2.663095 2.497590 1.320411
H -4.866568 -0.464829 -1.521329
H -3.711644 0.909812 -1.675572
H 4.805941 0.986152 -1.458832
H 4.070974 -0.635487 -1.730047
H -5.549931 0.523596 0.813739
H 5.704727 0.076846 0.832132
H -6.060782 2.935386 0.475702
H -4.956721 2.971416 -1.029416
H 6.814751 -2.102949 0.402638
H 5.779965 -2.346344 -1.131535


