%chk=000071980.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071980

0 1
 O    2.841200     -0.5967000       1.317400    
 O    2.886600      -1.441100     -0.9031000    
 N  -0.1257000       2.243100      0.1316000    
 N   -2.658500     -0.8084000       1.358400    
 C    1.379400      0.3769000     -0.3533000    
 C   7.4000000E-03  0.9841000     -0.6117000    
 C    1.568000      2.0300001E-02   1.123500    
 C    1.616500     -0.8670000      -1.213800    
 C   -1.116900      2.2000000E-02 -0.2695000    
 C    2.976600      -1.748900      0.4871000    
 C   -1.394000       2.890200     -0.1935000    
 C   0.9967000       3.128200     -0.1682000    
 C   -1.588400     -0.8478000      -1.223700    
 C   -1.657700      2.2100000E-02  0.9889000    
 C   -2.617700      -1.717900     -0.8812000    
 C   -3.113500      -1.659000      0.4112000    
 H    2.198700       1.046200     -0.6424000    
 H  -6.5099999E-02   1.210500      -1.687000    
 H    1.541900      0.9053000       1.765900    
 H   0.8186000     -0.6834000       1.496800    
 H   0.8725000      -1.652400      -1.058500    
 H    1.617600     -0.6091000      -2.278100    
 H    3.968700      -2.172100      0.6683000    
 H    2.235500      -2.510100      0.7613000    
 H   -2.282900       2.326600      0.1003000    
 H   -1.475500       3.115900      -1.264000    
 H   -1.476000       3.841200      0.3473000    
 H    1.183500       3.229200      -1.243900    
 H    1.917800       2.828000      0.3403000    
 H   0.7977000       4.135900      0.2185000    
 H   -1.188100     -0.8642000      -2.232600    
 H   -1.316500      0.6696000       1.789300    
 H   -3.020700      -2.418100      -1.603900    
 H   -3.916800      -2.315800      0.7282000    


%chk=000071980-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000071980

0 1
O 3.050028 -0.484957 1.298434
O 2.963310 -1.518503 -0.895859
N -0.149199 2.271613 0.077681
N -2.650719 -0.962733 1.377016
C 1.390888 0.310878 -0.347636
C 0.004975 0.969968 -0.641932
C 1.674840 0.044080 1.148319
C 1.588793 -1.019224 -1.114465
C -1.160488 0.032158 -0.310245
C 3.189967 -1.714838 0.532611
C -1.415216 2.953525 -0.288815
C 0.995263 3.196266 -0.097237
C -1.783892 -0.746647 -1.314824
C -1.645372 -0.111375 1.017853
C -2.826193 -1.634514 -0.966010
C -3.220868 -1.716170 0.388501
H 2.182329 0.990571 -0.714914
H -0.014888 1.141249 -1.755120
H 1.637517 0.961544 1.753370
H 0.953359 -0.693147 1.561172
H 0.860368 -1.786502 -0.773671
H 1.495136 -0.886947 -2.205296
H 4.232587 -2.041216 0.643305
H 2.464550 -2.471811 0.916539
H -2.280130 2.307439 -0.069872
H -1.457513 3.234810 -1.371136
H -1.518275 3.874403 0.310754
H 1.217196 3.424769 -1.169897
H 1.911077 2.797370 0.367477
H 0.756838 4.147876 0.408709
H -1.461731 -0.653153 -2.359339
H -1.226077 0.507399 1.818702
H -3.326438 -2.246124 -1.723504
H -4.021122 -2.394756 0.705229


