%chk=000154453.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154453

0 1
 O   -1.027400      0.3187000      0.3048000    
 O   0.4507000       1.901900       1.083900    
 N    2.856600       1.447200     -7.2400004E-02
 C    2.535700      0.1433000      2.7200000E-02
 C    1.240300     -0.2323000      0.3721000    
 C    3.481400     -0.8762000     -0.2095000    
 C   0.8725000      -1.575400      0.4846000    
 C    3.111700      -2.227200     -9.6400000E-02
 C   -2.119000       1.221400      0.5128000    
 C   -3.395900      0.5488000      0.1024000    
 C   0.2183000      0.7765000      0.6301000    
 C    1.809100      -2.574300      0.2501000    
 C    4.785600     -0.4987000     -0.5567000    
 C    5.119300      0.8441000     -0.6601000    
 C   -3.844900      0.6648000      -1.208400    
 C   -4.119100     -0.1843000       1.036900    
 C    4.126300       1.769300     -0.4099000    
 C   -5.032200      3.9600000E-02  -1.589600    
 C   -5.306200     -0.8096000      0.6556000    
 C   -5.762800     -0.6977000     -0.6577000    
 H  -0.1327000      -1.875000      0.7696000    
 H    3.837600      -3.017100     -0.2769000    
 H   -1.961900       2.132400     -7.8100003E-02
 H   -2.163300       1.509000       1.570500    
 H    1.528700      -3.619400      0.3401000    
 H    5.548700      -1.249400     -0.7484000    
 H    6.122700       1.153700     -0.9274000    
 H   -3.282700       1.234700      -1.942900    
 H   -3.771500     -0.2798000       2.061800    
 H    4.328500       2.833400     -0.4755000    
 H   -5.387600      0.1262000      -2.612300    
 H   -5.874800      -1.384200       1.381000    
 H   -6.687000      -1.184800     -0.9547000    


%chk=000154453-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154453

0 1
O -1.051502 0.088708 0.593053
O 0.369788 1.650608 1.587916
N 2.716625 1.489996 -0.243580
C 2.548563 0.129621 -0.023269
C 1.287025 -0.353637 0.484847
C 3.589219 -0.834119 -0.332119
C 1.072307 -1.735184 0.610503
C 3.342021 -2.232980 -0.155464
C -2.209649 0.913877 1.050105
C -3.449999 0.420375 0.340071
C 0.219342 0.592318 0.941951
C 2.098038 -2.675516 0.296330
C 4.838486 -0.332875 -0.825554
C 5.004898 1.039509 -1.009747
C -3.427113 0.134257 -1.048558
C -4.666373 0.283900 1.052681
C 3.904286 1.909285 -0.717530
C -4.603348 -0.278266 -1.711101
C -5.847159 -0.120145 0.388106
C -5.818619 -0.402733 -0.996380
H 0.100169 -2.086994 0.967899
H 4.139663 -2.949006 -0.388220
H -1.979874 1.970983 0.816182
H -2.299243 0.824379 2.148039
H 1.901865 -3.745529 0.419692
H 5.645002 -1.037950 -1.058710
H 5.944458 1.457929 -1.383414
H -2.482785 0.219727 -1.596696
H -4.692627 0.492676 2.129553
H 3.999373 2.989171 -0.884378
H -4.574367 -0.501815 -2.783544
H -6.782267 -0.220388 0.950411
H -6.731504 -0.720581 -1.512475


