%chk=000111295.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000111295

0 1
 O   -3.037100       1.378500      -1.035800    
 O   -2.250300      -1.514000       1.585900    
 N   -1.404200     -0.7502000     -0.4445000    
 N   -2.284500       2.400000      0.8790000    
 C  -0.9924000      0.5603000     -8.7000001E-03
 C   0.1822000       1.101900     -0.8312000    
 C    1.509700      0.5247000     -0.4039000    
 C   -2.199900       1.476500     -0.1418000    
 C    2.244900       1.167100      0.5800000    
 C    1.969800     -0.6378000      -1.002400    
 C   -2.000700      -1.679000      0.3946000    
 C    3.471600      0.6337000      0.9753000    
 C    3.196500      -1.171100     -0.6070000    
 C    3.947400     -0.5354000      0.3819000    
 C   -2.353100      -2.955200     -0.3214000    
 H  -0.7195000      0.4935000       1.052500    
 H   0.2345000       2.195500     -0.7376000    
 H   2.5900001E-02  0.9176000      -1.903000    
 H   -1.316300     -0.9728000      -1.432200    
 H    1.881500       2.076500       1.050100    
 H    1.393100      -1.140400      -1.773400    
 H    4.055900       1.128200       1.745800    
 H    3.567100      -2.081600      -1.068900    
 H    4.902400     -0.9510000      0.6898000    
 H   -3.052000       3.062400      0.9188000    
 H   -1.587100       2.468200       1.613400    
 H   -2.568700      -3.739500      0.4095000    
 H   -3.235800      -2.789700     -0.9450000    
 H   -1.519600      -3.283300     -0.9492000    


%chk=000111295-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000111295

0 1
O -2.116198 2.532101 -1.598674
O -2.545164 -0.633814 1.655983
N -1.179377 -0.487129 -0.213518
N -3.250342 1.704264 0.267759
C -0.929069 0.966235 -0.073578
C 0.338305 1.376629 -0.860947
C 1.567166 0.555984 -0.496953
C -2.155350 1.811818 -0.556257
C 2.162417 0.663785 0.787678
C 2.141127 -0.342710 -1.432557
C -1.921495 -1.206945 0.695922
C 3.293740 -0.108322 1.129024
C 3.274642 -1.119448 -1.095445
C 3.853205 -1.006226 0.188598
C -1.962580 -2.715039 0.502864
H -0.798494 1.161392 1.009055
H 0.507502 2.450172 -0.662025
H 0.116767 1.306549 -1.941283
H -0.677844 -0.980447 -0.955195
H 1.741035 1.361654 1.522447
H 1.710722 -0.418285 -2.439938
H 3.742359 -0.008621 2.123903
H 3.707475 -1.803435 -1.834293
H 4.732933 -1.603665 0.452488
H -4.102630 2.206434 0.018006
H -3.230823 1.024085 1.046293
H -1.562481 -3.202019 1.408872
H -3.011313 -3.040047 0.393364
H -1.384935 -3.061350 -0.370995


