%chk=000126589.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126589

0 1
 O   0.6989000       2.721700      0.1430000    
 O    2.883000      -2.275500     -0.1025000    
 N   -4.083000     -0.6778000      3.9999999E-02
 C   -2.032000      0.4402000     -0.7738000    
 C  -0.7699000       1.108100     -0.4059000    
 C   -2.857600     -3.7400000E-02  0.4366000    
 C   0.4997000      0.5007000     -0.2189000    
 C    1.367700       1.534600      0.1170000    
 C  -0.5943000       2.452900     -0.1747000    
 C    1.010700     -0.8067000     -0.2963000    
 C    2.724300       1.360300      0.3847000    
 C    2.371600      -1.013500     -3.2000002E-02
 C   -4.879900      -1.079300       1.209500    
 C   -3.823300      -1.853900     -0.8045000    
 C    3.211000      5.2299999E-02  0.3020000    
 C    4.273100      -2.426700      0.1758000    
 H   -1.772800     -0.3981000      -1.430100    
 H   -2.642100       1.123500      -1.380000    
 H   -2.241500     -0.7036000       1.056700    
 H   -3.083400      0.8390000       1.059100    
 H   -1.255200       3.307400     -0.1940000    
 H   0.3670000      -1.642900     -0.5539000    
 H    3.368200       2.192600      0.6432000    
 H   -5.111500     -0.2078000       1.831900    
 H   -4.358100      -1.818500       1.828000    
 H   -5.839800      -1.503200      0.8943000    
 H   -3.467300      -1.568200      -1.798700    
 H   -4.753300      -2.406800     -0.9843000    
 H   -3.106100      -2.544400     -0.3463000    
 H    4.269300     -6.1999999E-02  0.5141000    
 H    4.508300      -3.491400      7.3899999E-02
 H    4.511200      -2.146600       1.207600    
 H    4.891500      -1.893900     -0.5546000    


%chk=000126589-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000126589

0 1
O 0.744107 2.935980 0.029657
O 2.745402 -2.272365 0.006613
N -4.004958 -0.804706 0.073533
C -2.083288 0.564004 -0.825173
C -0.792971 1.261351 -0.476136
C -2.685232 -0.205561 0.381496
C 0.507044 0.636235 -0.227806
C 1.415373 1.692450 0.077085
C -0.595700 2.618381 -0.312865
C 0.982774 -0.694275 -0.244475
C 2.767689 1.489363 0.368114
C 2.348308 -0.920660 0.044946
C -4.731676 -1.193022 1.301132
C -3.926833 -1.926615 -0.885140
C 3.235933 0.154994 0.351008
C 4.147514 -2.578339 0.287807
H -1.900724 -0.137276 -1.662477
H -2.839916 1.290699 -1.172350
H -1.951600 -0.975063 0.738153
H -2.824206 0.511542 1.211997
H -1.261247 3.473611 -0.399871
H 0.338496 -1.547662 -0.474518
H 3.435970 2.323768 0.597616
H -4.843840 -0.314799 1.961538
H -4.221536 -2.002007 1.884369
H -5.742451 -1.551964 1.035741
H -3.504599 -1.587869 -1.846229
H -4.943350 -2.310015 -1.084601
H -3.301897 -2.778747 -0.511169
H 4.288621 -0.038559 0.574350
H 4.225688 -3.672035 0.198153
H 4.433887 -2.268957 1.312497
H 4.823618 -2.096782 -0.446096


