%chk=000115181.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115181

0 1
 O  -0.6246000      -2.112500     -0.7627000    
 O    2.153600      -1.760600     -0.5897000    
 O   -1.328900     -0.6183000       1.558600    
 O    3.215300      0.1746000       1.116200    
 O    2.891100       2.420000     -0.4939000    
 N   -3.418000      0.9023000      0.3430000    
 C  -9.0300001E-02 -0.8138000     -0.5123000    
 C    1.277300     -0.9563000      0.1977000    
 C   -1.120700      7.1999999E-03  0.2944000    
 C    1.968000      0.3995000      0.4622000    
 C   -2.469000      0.1082000     -0.4347000    
 C    2.225300       1.208100     -0.8098000    
 C   -4.679100       1.041700     -0.3689000    
 H   4.6500001E-02 -0.3607000      -1.500200    
 H    1.152900      -1.499800       1.141900    
 H  -0.7393000       1.016500      0.4800000    
 H    1.369200      0.9950000       1.159500    
 H   -2.890100     -0.8943000     -0.5761000    
 H   -2.312600      0.5595000      -1.422000    
 H    1.292400       1.473600      -1.313100    
 H    2.857500      0.6591000      -1.515400    
 H   4.3400001E-02  -2.611100      -1.263600    
 H    2.999500      -1.824000     -0.1140000    
 H   -3.025800       1.827100      0.5181000    
 H   -1.645400      -1.522900       1.393100    
 H    3.542400       1.033600       1.432400    
 H   -5.144300      6.6900000E-02 -0.5481000    
 H   -4.546900       1.556900      -1.326000    
 H   -5.375500       1.631000      0.2357000    
 H    3.795500       2.196000     -0.2167000    


%chk=000115181-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000115181

0 1
O -0.392549 -2.391191 -0.423551
O 2.160442 -1.652167 -0.223223
O -1.611211 -0.900054 1.495615
O 3.134524 0.686425 0.866730
O 2.698556 2.557263 -1.105533
N -3.828584 0.204745 -0.152407
C -0.112399 -0.943486 -0.450581
C 1.188111 -0.694740 0.338212
C -1.352886 -0.278876 0.182932
C 1.765133 0.734200 0.262042
C -2.612739 -0.397810 -0.722277
C 1.995303 1.276877 -1.157816
C -3.860907 1.678740 -0.114748
H 0.016888 -0.610788 -1.501336
H 0.999139 -0.941301 1.405832
H -1.151437 0.784773 0.406327
H 1.134113 1.440940 0.835308
H -2.795306 -1.471635 -0.915835
H -2.409389 0.082319 -1.701185
H 1.033816 1.487700 -1.654365
H 2.553276 0.527218 -1.755829
H 0.482003 -2.851010 -0.539406
H 3.053168 -1.404510 0.136864
H -4.041509 -0.212417 0.763203
H -1.524917 -1.880823 1.335587
H 3.073688 0.811343 1.846281
H -3.770908 2.071938 -1.144964
H -3.063869 2.162652 0.501811
H -4.835916 2.012794 0.282291
H 3.495765 2.413382 -0.530381


