%chk=000100162.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000100162

0 1
 O   0.6638000       1.064600      0.2137000    
 O    2.116300     -0.7884000     -2.5300000E-02
 O   -1.236600       2.213600      0.7736000    
 O   -3.087600      0.2146000       1.239000    
 O    3.394100       1.096800     -0.4134000    
 C   -1.389200      9.7599998E-02 -0.4361000    
 C  -0.2953000     -0.9804000     -0.4032000    
 C   0.9663000     -0.1267000     -0.5238000    
 C  -0.6931000       1.247600      0.2598000    
 C   -1.739400      0.5344000      -1.863600    
 C  -0.2950000      -1.826500      0.8806000    
 C   -2.666900     -0.3356000      0.2225000    
 C   -3.408900      -1.474300     -0.4234000    
 C    3.273200     -5.7500001E-02 -2.5800001E-02
 C    4.398200     -0.8798000      0.5255000    
 H  -0.3607000      -1.673300      -1.250600    
 H    1.145500      0.1512000      -1.570700    
 H  -0.9089000       1.060100      -2.348400    
 H   -2.002300     -0.3188000      -2.498600    
 H   -2.592100       1.224500      -1.867000    
 H  -0.2131000      -1.203100       1.777500    
 H   -1.200200      -2.433400      0.9705000    
 H   0.5469000      -2.527300      0.8826000    
 H   -4.058900      -1.085800      -1.211300    
 H   -2.727000      -2.215800     -0.8438000    
 H   -4.023600      -1.974200      0.3311000    
 H    4.552000      -1.762900     -9.9500000E-02
 H    4.174100      -1.170600       1.554800    
 H    5.316900     -0.2862000      0.5229000    


%chk=000100162-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000100162

0 1
O 0.565705 1.194853 0.304234
O 2.143083 -0.567415 0.247139
O -1.459336 2.203322 0.836047
O -2.744901 -0.483123 1.571827
O 3.600635 0.447372 -1.291583
C -1.424359 0.018791 -0.417732
C -0.212433 -0.993964 -0.425350
C 0.995215 -0.016293 -0.443244
C -0.855321 1.246629 0.344154
C -1.763268 0.504484 -1.857718
C -0.171609 -1.963122 0.775903
C -2.653496 -0.570976 0.322709
C -3.702258 -1.303112 -0.502021
C 3.434701 -0.200187 -0.242260
C 4.491477 -0.722014 0.696517
H -0.216111 -1.575553 -1.365603
H 1.302385 0.313484 -1.451317
H -0.872385 0.931313 -2.352428
H -2.125669 -0.330130 -2.481703
H -2.537270 1.291050 -1.832132
H -0.225118 -1.425930 1.737549
H -1.019397 -2.669392 0.735468
H 0.763982 -2.544652 0.758274
H -4.230981 -0.603397 -1.175589
H -3.238818 -2.078372 -1.141776
H -4.433654 -1.770891 0.174388
H 4.336067 -1.796144 0.893972
H 4.412778 -0.197912 1.665412
H 5.488855 -0.554318 0.266463


