%chk=000027860.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000027860

0 1
 O   -1.414600       2.297200      -1.220100    
 O    5.499800      0.9243000      0.9389000    
 O    3.488000      0.7004000       1.967000    
 N  -8.7499999E-02  0.5786000     -0.5809000    
 C    2.140400      0.2863000     -0.4977000    
 C    1.535100     -0.9918000     -0.4716000    
 C    1.136600       1.219900     -0.5573000    
 C   0.1475000     -0.7993000     -0.5201000    
 C    3.591700      0.5664000     -0.4622000    
 C    2.053500      -2.302200     -0.4086000    
 C  -0.7307000      -1.900300     -0.5175000    
 C    1.295700       2.693200     -0.5972000    
 C   -1.340000       1.229300     -0.6211000    
 C    1.179700      -3.391100     -0.3999000    
 C  -0.1935000      -3.190300     -0.4550000    
 C   -2.576400      0.7112000     -4.4999998E-03
 C    4.154300      0.7322000      0.9415000    
 C   -2.502400     -8.3400004E-02   1.136800    
 C   -3.812200       1.020900     -0.5665000    
 C   -3.671800     -0.5713000       1.719800    
 C   -4.981700      0.5330000      1.6600000E-02
 C   -4.911600     -0.2631000       1.159700    
 H    3.826400       1.473800      -1.029600    
 H    4.138400     -0.2566000     -0.9382000    
 H    3.125400      -2.475300     -0.3667000    
 H   -1.801700      -1.794300     -0.6383000    
 H   0.6083000       3.185600      9.8600000E-02
 H    2.302000       3.008200     -0.3049000    
 H    1.110900       3.073500      -1.606900    
 H    1.578100      -4.400900     -0.3556000    
 H  -0.8617000      -4.047700     -0.4680000    
 H   -1.558500     -0.2959000       1.630500    
 H   -3.888400       1.634800      -1.460100    
 H   -3.618200      -1.180800       2.617100    
 H   -5.947000      0.7722000     -0.4199000    
 H   -5.822300     -0.6408000       1.615200    
 H    5.855100       1.030900       1.847000    


%chk=000027860-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000027860

0 1
O -1.483690 2.260853 -1.510256
O 5.486807 0.409159 1.113000
O 3.467313 1.079664 2.043260
N -0.128250 0.576531 -0.608007
C 2.150175 0.330280 -0.512360
C 1.549958 -0.994958 -0.490990
C 1.128819 1.267401 -0.604458
C 0.128283 -0.831245 -0.557535
C 3.623367 0.608452 -0.400941
C 2.108352 -2.296033 -0.451652
C -0.738888 -1.940062 -0.643424
C 1.219136 2.765315 -0.602651
C -1.391976 1.220110 -0.799054
C 1.244518 -3.408837 -0.504493
C -0.161871 -3.229503 -0.608928
C -2.576649 0.659319 -0.075543
C 4.118844 0.725950 1.040211
C -2.456539 0.053337 1.203472
C -3.862586 0.854705 -0.644024
C -3.612551 -0.363089 1.896703
C -5.013997 0.420369 0.043221
C -4.891037 -0.189269 1.315434
H 3.889808 1.559926 -0.901027
H 4.221192 -0.172175 -0.902755
H 3.193443 -2.437422 -0.391538
H -1.821731 -1.826528 -0.731423
H 0.614241 3.205985 0.211151
H 2.264589 3.075519 -0.442847
H 0.847598 3.200095 -1.545445
H 1.657396 -4.423142 -0.476308
H -0.815813 -4.106461 -0.666925
H -1.467558 -0.076458 1.654635
H -3.937324 1.354335 -1.615549
H -3.517411 -0.819452 2.887707
H -6.003733 0.561649 -0.404044
H -5.786573 -0.519633 1.853533
H 5.801039 0.532110 2.050153


