%chk=000161158.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161158

0 1
 O   -2.390900     -0.6962000     -0.2512000    
 O    1.923800       1.243000      -1.467200    
 O    3.592000       1.683000      6.2000002E-03
 O   -2.324500      -2.936000     -0.6263000    
 O   -3.686300       1.523700     -0.2724000    
 O   -1.950900       2.792500      0.5078000    
 N    4.024400      -1.017300      0.2574000    
 C    1.704500     -0.8186000       1.038700    
 C    2.681400     -0.5774000     -0.1175000    
 C   0.2792000     -0.8314000      0.5802000    
 C  -0.4257000      0.4265000      0.5774000    
 C  -0.3483000      -1.946300      0.1816000    
 C    2.803100      0.8906000     -0.4916000    
 C   -1.699600      0.4525000      0.1739000    
 C   -1.758000      -1.910100     -0.2634000    
 C   -2.424300       1.721500      0.1665000    
 H    1.848500     -7.6600000E-02   1.835800    
 H    1.920600      -1.791000       1.504400    
 H    2.391200      -1.145000      -1.010100    
 H   9.6699998E-02   1.317700      0.9081000    
 H   0.1520000      -2.908600      0.1693000    
 H    4.648900     -0.9356000     -0.5444000    
 H    4.006200      -2.007300      0.5001000    
 H    2.004000       2.191100      -1.705900    
 H   -4.204600       2.356400     -0.2909000    


%chk=000161158-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000161158

0 1
O -2.495061 -0.625960 -0.129767
O 2.862066 0.894206 -2.000428
O 2.488946 1.760188 0.126631
O -2.607524 -2.916359 -0.516585
O -3.815380 1.661540 -0.150082
O -1.964694 2.874925 0.572141
N 4.052406 -1.053772 0.213194
C 1.702703 -0.976885 0.992378
C 2.676097 -0.706187 -0.188392
C 0.238136 -0.874656 0.608004
C -0.429953 0.407128 0.608513
C -0.478378 -2.006897 0.239673
C 2.625282 0.768542 -0.627197
C -1.760625 0.479310 0.246888
C -1.876266 -1.979220 -0.160862
C -2.491326 1.783458 0.247368
H 1.932211 -0.257516 1.801403
H 1.937225 -1.992602 1.352993
H 2.401512 -1.336066 -1.050850
H 0.090017 1.324464 0.895568
H -0.011954 -2.996943 0.239068
H 4.423231 -0.492622 0.986971
H 4.712772 -1.154440 -0.562646
H 2.897599 1.858141 -2.250594
H -4.245640 2.559325 -0.126889


