%chk=000137348.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000137348

0 1
 O   -4.249900      -1.661300     -0.6442000    
 O   -1.036800      0.7736000      -1.538300    
 N   -3.269300      0.4358000     -0.2943000    
 N   6.8599999E-02   1.642800      0.3169000    
 C   -2.224100      0.9929000      0.5170000    
 C   -2.039300     -3.0600000E-02   1.621100    
 C   -2.479000      -1.351100      0.9894000    
 C   -3.462800     -0.9234000     -7.2099999E-02
 C   -1.020500       1.122000     -0.3606000    
 C    1.359700       1.846200     -0.2997000    
 C    2.243100      0.6398000     -0.1645000    
 C    3.077400      0.5191000      0.9407000    
 C    2.217800     -0.3446000      -1.145400    
 C    3.898200     -0.6017000       1.066600    
 C    3.038500      -1.465500      -1.019400    
 C    3.878600      -1.594000      8.6599998E-02
 H   -2.527900       1.975600      0.8894000    
 H   -2.716900      0.2053000       2.451800    
 H   -1.027300     -9.5100001E-02   2.030900    
 H   -2.952300      -2.012900       1.718800    
 H   -1.640000      -1.861700      0.5064000    
 H   -3.788500      0.9647000     -0.9882000    
 H  -2.9100001E-02   1.896900       1.295600    
 H    1.820200       2.717600      0.1798000    
 H    1.221400       2.102000      -1.357100    
 H    3.099100       1.284900       1.711200    
 H    1.570300     -0.2555000      -2.012900    
 H    4.551900     -0.7021000       1.928100    
 H    3.023800      -2.238000      -1.782700    
 H    4.517500      -2.466800      0.1847000    


%chk=000137348-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000137348

0 1
O -5.420170 0.168306 -0.650478
O -1.248147 0.657913 -1.445112
N -3.487591 1.040061 0.383233
N 0.147985 1.293412 0.313164
C -2.166911 0.614487 0.848055
C -2.377384 -0.928491 1.067283
C -3.518701 -1.299934 0.091012
C -4.289526 0.014624 -0.122122
C -1.062019 0.869570 -0.209417
C 1.348039 1.493670 -0.523828
C 2.504700 0.582570 -0.127535
C 3.748932 1.125985 0.275089
C 2.352512 -0.827885 -0.170996
C 4.825186 0.278670 0.628609
C 3.423977 -1.675734 0.182180
C 4.664771 -1.124474 0.584065
H -1.898795 1.115452 1.798974
H -2.692817 -1.098234 2.111660
H -1.448227 -1.495411 0.892314
H -4.194276 -2.082241 0.471248
H -3.132771 -1.622295 -0.892183
H -3.728429 2.017612 0.214053
H 0.238536 1.427149 1.322524
H 1.663512 2.553138 -0.470916
H 1.016594 1.292087 -1.559446
H 3.879332 2.215189 0.308168
H 1.395826 -1.255919 -0.494621
H 5.783409 0.711870 0.936445
H 3.297638 -2.763357 0.138140
H 5.497213 -1.782892 0.856040


