%chk=000126732.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126732

0 1
 I   -6.138400     -0.3650000       1.391200    
 O  -0.3857000      5.5700000E-02 -0.9619000    
 N    3.074400       3.277500      0.1933000    
 C   0.6638000      0.3065000     -2.4900001E-02
 C    1.336100       1.645000     -0.3713000    
 C    1.604000     -0.8759000     -5.0999999E-02
 C    2.491300       1.993700      0.5678000    
 C   -1.651900     -2.5200000E-02 -0.4531000    
 C    1.772800      -1.582200      -1.230700    
 C    2.278700      -1.231300       1.105400    
 C   -2.644100      0.8545000     -0.8786000    
 C    2.640400      -2.674100      -1.254700    
 C    3.146500      -2.323200       1.081500    
 C   -1.938000      -1.001100      0.4982000    
 C    3.327200      -3.044600     -9.8600000E-02
 C    4.150400       3.643400       1.103200    
 C   -3.930900      0.7576000     -0.3492000    
 C   -2.350200       1.905300      -1.897800    
 C   -3.225000      -1.098000       1.027400    
 C   -4.221300     -0.2186000      0.6038000    
 H   0.2534000      0.4036000      0.9911000    
 H   0.5767000       2.437500     -0.3451000    
 H    1.695200       1.614800      -1.409300    
 H    3.274700       1.232400      0.5024000    
 H    2.124500       2.027300       1.600700    
 H    1.262600      -1.305600      -2.148600    
 H    2.142400     -0.6808000       2.031700    
 H    2.354900       3.999600      0.2154000    
 H   -1.178300      -1.702700      0.8305000    
 H    2.784200      -3.233800      -2.174400    
 H    3.680600      -2.612300       1.982000    
 H    4.003300      -3.894300     -0.1174000    
 H   -4.704100       1.446700     -0.6818000    
 H    4.576100       4.603700      0.7961000    
 H    3.789600       3.749300       2.131500    
 H    4.958000       2.904400       1.081000    
 H   -1.722600       2.689000      -1.462000    
 H   -1.835600       1.472700      -2.762300    
 H   -3.265600       2.376200      -2.272200    
 H   -3.430600      -1.868000       1.766700    


%chk=000126732-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126732

0 1
I -6.057739 -1.920124 0.693822
O -0.523209 0.977113 -0.555357
N 3.626448 3.333005 0.303569
C 0.682733 0.831395 0.302773
C 1.584825 2.006483 -0.128456
C 1.350530 -0.529596 0.122987
C 2.846569 2.160803 0.743069
C -1.699831 0.283421 -0.219098
C 1.446479 -1.116997 -1.162711
C 1.926480 -1.196324 1.231989
C -2.820335 0.580815 -1.050886
C 2.108445 -2.351774 -1.334970
C 2.596179 -2.429201 1.060428
C -1.813256 -0.631520 0.852997
C 2.688239 -3.010698 -0.224851
C 4.897284 3.532293 1.023164
C -4.048958 -0.059055 -0.771592
C -2.682292 1.561044 -2.197096
C -3.050940 -1.262557 1.118909
C -4.160166 -0.968538 0.304335
H 0.381758 0.967408 1.364236
H 0.976614 2.931516 -0.074698
H 1.888298 1.871591 -1.182020
H 3.487317 1.264548 0.636806
H 2.550622 2.214664 1.825529
H 0.986169 -0.609575 -2.017869
H 1.851743 -0.751985 2.233366
H 3.051032 4.185617 0.286579
H -0.949931 -0.887089 1.471274
H 2.170961 -2.802571 -2.331751
H 3.038039 -2.936266 1.925529
H 3.201194 -3.969454 -0.359554
H -4.916296 0.162451 -1.400939
H 5.400955 4.438968 0.643948
H 4.791126 3.631301 2.132101
H 5.567716 2.674148 0.830274
H -2.349894 2.550874 -1.834292
H -1.916167 1.222992 -2.918943
H -3.638750 1.684006 -2.732459
H -3.130491 -1.973430 1.945861


