%chk=000157365.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000157365

0 1
 O    6.310300      0.2865000      0.6589000    
 O    4.372800       1.062000       1.542500    
 N   -1.392900     -0.1392000     -5.6600001E-02
 N   -2.009900       1.042400     -0.2523000    
 C    4.253500     -0.4702000     -0.3560000    
 C    2.766800     -0.3832000     -0.2778000    
 C  -3.7000000E-03 -0.2212000     -0.1324000    
 C   -3.480800     -0.6357000      0.1728000    
 C    2.014400      -1.526200     -7.1000000E-03
 C    2.128400      0.8413000     -0.4752000    
 C   0.6238000      -1.444900      6.5800004E-02
 C   0.7379000      0.9226000     -0.4021000    
 C   -2.230200      -1.184700      0.2032000    
 C   -3.319600      0.7693000     -0.1162000    
 C    4.831800     -7.7399999E-02  -1.730700    
 C    4.954800      0.3712000      0.7162000    
 C   -4.671200      -1.320000      0.3832000    
 C   -4.441600       1.612800     -0.2132000    
 C   -5.775900     -0.4517000      0.2805000    
 C   -5.668700      0.9463000     -3.5999999E-03
 H    4.556200      -1.507100     -0.1548000    
 H    2.496500      -2.487800      0.1490000    
 H    2.696800       1.742700     -0.6880000    
 H   9.8200001E-02  -2.368500      0.2791000    
 H   0.2816000       1.895600     -0.5618000    
 H   -1.920300      -2.203600      0.3861000    
 H    4.328500     -0.6270000      -2.533700    
 H    4.713000      0.9939000      -1.928000    
 H    5.901400     -0.3055000      -1.791900    
 H   -4.766300      -2.374900      0.5985000    
 H   -4.382700       2.671700     -0.4270000    
 H   -6.773200     -0.8664000      0.4256000    
 H   -6.588300       1.527700     -6.1099999E-02
 H    6.739900      0.8353000       1.349200    


%chk=000157365-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000157365

0 1
O 5.493483 -0.121388 1.664209
O 5.213878 1.787520 0.373385
N -1.358214 -0.249270 -0.029240
N -1.999978 0.982502 -0.202259
C 4.432656 -0.407300 -0.492220
C 2.905321 -0.357883 -0.338836
C 0.072318 -0.298865 -0.128328
C -3.531321 -0.744863 0.220030
C 2.174735 -1.539908 -0.070977
C 2.191698 0.859025 -0.491814
C 0.768781 -1.520054 0.032264
C 0.789086 0.894801 -0.387984
C -2.232069 -1.295914 0.222916
C -3.333888 0.673154 -0.048276
C 4.881655 -0.048653 -1.932427
C 5.073122 0.552323 0.509511
C -4.848635 -1.267091 0.409801
C -4.447979 1.562637 -0.125717
C -5.924195 -0.378557 0.329316
C -5.723486 1.024352 0.063652
H 4.776406 -1.423896 -0.235498
H 2.707279 -2.488881 0.060547
H 2.739162 1.789241 -0.680785
H 0.237219 -2.453958 0.237239
H 0.229861 1.825927 -0.501294
H -1.897237 -2.315944 0.381897
H 4.390951 -0.720596 -2.657132
H 4.610846 0.992046 -2.177332
H 5.976171 -0.150893 -2.041841
H -5.010587 -2.331200 0.612069
H -4.293832 2.627025 -0.327198
H -6.946439 -0.746979 0.469996
H -6.599916 1.679975 0.010442
H 5.864445 0.537662 2.312985


