%chk=000149101.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000149101

0 1
 O   -2.790100     -0.4341000       1.113500    
 O   -2.238500       2.227300      -1.225700    
 O   -4.611200       1.670700     -1.4000000E-03
 O   -4.901300      -2.087900      -1.348600    
 O   0.3145000       2.236100      0.9115000    
 O    7.134200      0.3308000      -1.634500    
 N  -0.5935000      0.1438000      0.5606000    
 N    1.785200      0.5181000      0.7182000    
 N    3.286900      -1.246200      0.5175000    
 N    4.284000     -0.3090000      0.6052000    
 C   -2.478400      0.8943000     -0.8239000    
 C   -3.955000      0.5960000     -0.6734000    
 C   -1.953900      0.6009000      0.5711000    
 C   -3.944200     -0.6054000      0.2619000    
 C   -3.802600      -1.934800     -0.4673000    
 C  -0.3465000      -1.206800      0.3679000    
 C   0.4990000       1.029800      0.7396000    
 C   0.8828000      -1.718100      0.3428000    
 C    2.000900     -0.7582000      0.5355000    
 C    5.128200     -0.4559000     -0.5733000    
 C    6.299400      0.5086000     -0.4971000    
 H   -2.031200      0.2235000      -1.567400    
 H   -4.470900      0.4368000      -1.624000    
 H   -2.036300       1.481300       1.219800    
 H   -4.838200     -0.6216000      0.8959000    
 H   -3.786000      -2.766200      0.2453000    
 H   -2.887800      -1.985400      -1.063000    
 H   -2.681100       2.358500      -2.081600    
 H   -4.508700       2.463200     -0.5557000    
 H   -1.182500      -1.876200      0.2365000    
 H   -4.794400      -2.945700      -1.793800    
 H    1.083500      -2.770700      0.1946000    
 H    3.512600      -2.231400      0.4275000    
 H    4.831900     -0.4930000       1.445000    
 H    4.558700     -0.2566000      -1.490500    
 H    5.515900      -1.479700     -0.6622000    
 H    6.902300      0.3265000      0.3992000    
 H    5.952200       1.547400     -0.4828000    
 H    7.868500      0.9628000      -1.550900    


%chk=000149101-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000149101

0 1
O -2.594535 -0.923469 0.777345
O -1.854007 2.523286 -0.168348
O -4.268517 1.758609 0.505889
O -5.134460 -1.382207 -1.975844
O 0.519210 1.856900 0.723944
O 5.679344 0.595296 -2.535656
N -0.275907 -0.347258 0.659305
N 2.093750 0.128203 0.698857
N 3.647221 -1.603067 0.644689
N 4.717634 -0.687091 0.878279
C -2.090439 1.118991 -0.418637
C -3.625114 0.892056 -0.476798
C -1.664731 0.199709 0.770792
C -3.807877 -0.568731 -0.040585
C -3.908706 -1.583100 -1.195332
C -0.026591 -1.705370 0.616358
C 0.809850 0.611549 0.697398
C 1.267843 -2.188533 0.595967
C 2.328722 -1.210155 0.636009
C 5.502096 -0.356452 -0.346607
C 4.726101 0.420135 -1.427355
H -1.598377 0.770324 -1.349850
H -4.037264 1.069642 -1.487818
H -1.730915 0.768448 1.719695
H -4.682396 -0.642638 0.631793
H -3.846469 -2.610991 -0.782551
H -3.088441 -1.444693 -1.919726
H -0.908191 2.575747 0.198043
H -3.697615 2.579738 0.545645
H -0.911582 -2.343646 0.608323
H -5.923205 -1.540175 -1.397248
H 1.460729 -3.262422 0.559277
H 3.887440 -2.587996 0.763256
H 4.294578 0.158663 1.298378
H 5.894155 -1.292541 -0.782024
H 6.370304 0.239566 -0.014531
H 4.378714 1.393756 -1.024898
H 3.837514 -0.160058 -1.751574
H 5.268533 1.153475 -3.241861


