%chk=000161218.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161218

0 1
 O   8.7600000E-02   3.364200     -6.6500001E-02
 O    2.467100       3.630400     -0.1554000    
 O   -3.593900      -2.321200      0.2304000    
 O   -4.630300       2.295000      0.1216000    
 O    3.820500      -1.391400       1.217200    
 O    3.883800      -1.604800      -1.044900    
 O    1.627000      -3.224700      -1.014700    
 O    1.701100      -3.157300       1.178300    
 N    1.324100      -2.696500      7.8100003E-02
 C   9.8700002E-02  0.8854000      8.6000003E-03
 C    1.004900     -0.2137000      1.2300000E-02
 C   -1.326900      0.6211000      6.4000003E-02
 C   0.7196000       2.151900     -5.1199999E-02
 C   -1.774700     -0.7257000      0.1207000    
 C   0.5154000      -1.519600      6.9300003E-02
 C    2.404400     -1.5100000E-02 -4.0899999E-02
 C    2.090600       2.323000     -0.1026000    
 C  -0.8504000      -1.771800      0.1227000    
 C    2.958400       1.259400     -9.9200003E-02
 C   -2.340400       1.614200      6.6200003E-02
 C   -3.145800      -1.030100      0.1754000    
 C    1.189600       4.284400     -0.1329000    
 C   -3.702000       1.299400      0.1207000    
 C   -4.105200     -2.4100000E-02  0.1754000    
 C    3.423100      -1.065100     -3.9700001E-02
 C   -3.846300      -2.967300      -1.013000    
 H   -1.187800      -2.806600      0.1750000    
 H    4.030700       1.422200     -0.1401000    
 H   -2.083300       2.667400      2.4900001E-02
 H    1.147400       4.947200      0.7389000    
 H    1.087200       4.891200      -1.039800    
 H   -5.162400     -0.2720000      0.2193000    
 H   -4.175900       3.153800      7.9899997E-02
 H   -4.090800      -4.013900     -0.8118000    
 H   -2.967800      -2.934000      -1.665000    
 H   -4.699800      -2.501100      -1.515600    
 H    4.502700      -2.096300       1.213600    


%chk=000161218-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161218

0 1
O 0.050590 3.332005 0.086564
O 2.393455 3.743828 0.281188
O -3.334454 -2.507490 -0.505796
O -4.528216 2.188226 -0.606837
O 4.872758 -0.754310 0.327334
O 3.456069 -2.002701 -1.019290
O 1.076467 -3.974998 0.371221
O 2.403305 -2.541955 1.540912
N 1.437351 -2.785564 0.712324
C 0.220269 0.789705 0.049174
C 1.195470 -0.293193 0.118694
C -1.208148 0.519141 -0.133840
C 0.757045 2.098635 0.135959
C -1.632658 -0.853866 -0.216451
C 0.648233 -1.637303 0.207662
C 2.605589 0.002956 0.097671
C 2.130257 2.351903 0.248011
C -0.695485 -1.906733 0.001668
C 3.079543 1.331481 0.196768
C -2.179928 1.552697 -0.255916
C -3.027143 -1.151539 -0.436997
C 1.064889 4.377217 0.415119
C -3.527966 1.217808 -0.469135
C -3.971883 -0.126649 -0.565651
C 3.622325 -1.036866 -0.237508
C -4.735326 -2.888199 -0.722499
H -1.049571 -2.938144 0.059917
H 4.150535 1.538608 0.198777
H -1.875314 2.599754 -0.195430
H 0.912136 4.699801 1.462345
H 0.976959 5.198327 -0.311620
H -5.033832 -0.312475 -0.737431
H -4.149986 3.099986 -0.535181
H -4.732190 -3.987136 -0.734330
H -5.104038 -2.501723 -1.691331
H -5.378099 -2.520664 0.099653
H 5.511190 -1.462668 0.043481


