%chk=000178806.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178806

0 1
 O    1.184000     -0.5738000      0.2852000    
 O  -0.2108000       1.148800       1.013400    
 O    4.505600       1.830400      0.5282000    
 O    4.582800     -0.5988000      -1.065900    
 O    1.815200       3.022100      0.4045000    
 O    3.333800      -2.989500      -1.082200    
 O    1.669900      -3.073500      0.4736000    
 O   -2.051000       2.215200     -0.7764000    
 O   -5.872300      -1.126500     -0.8054000    
 C    3.368700       1.249500     -0.1123000    
 C    3.559200     -0.2675000     -0.1291000    
 C    2.099700       1.644000      0.6440000    
 C    2.271600     -0.9690000     -0.5431000    
 C   0.8993000      0.8189000      0.1793000    
 C    2.365200      -2.441900     -0.3082000    
 C   -1.386200      0.4985000      0.7544000    
 C   -2.304500       1.036200     -0.1428000    
 C   -1.652200     -0.7069000       1.397900    
 C   -3.499100      0.3630000     -0.3987000    
 C   -2.846800      -1.380000       1.142000    
 C   -3.770300     -0.8450000      0.2438000    
 C   -5.015600      -1.547200     -2.2900000E-02
 C   -3.046300       2.693000      -1.679200    
 H    3.345500       1.656700      -1.130800    
 H    3.897500     -0.6115000      0.8562000    
 H    2.247000       1.528800       1.725000    
 H    2.011400     -0.8071000      -1.596500    
 H   0.6399000       1.070800     -0.8584000    
 H    5.293500       1.553900      2.9500000E-02
 H    4.295300     -0.2991000      -1.945100    
 H    2.595800       3.531800      0.6812000    
 H  -0.9402000      -1.127600       2.102400    
 H    3.412200      -3.957000     -0.9413000    
 H   -4.247300      0.7384000      -1.088200    
 H   -3.044100      -2.319900       1.651100    
 H   -5.173100      -2.497600      0.5149000    
 H   -3.986400       2.916500      -1.163300    
 H   -3.184600       2.011900      -2.525900    
 H   -2.678900       3.638900      -2.091100    


%chk=000178806-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000178806

0 1
O 1.140586 -0.492873 -0.005563
O -0.207423 0.771430 1.407917
O 4.425989 1.890417 0.961160
O 4.628918 0.145959 -1.303435
O 1.790197 2.874465 1.464171
O 3.534767 -2.206045 -2.129891
O 1.418762 -2.855755 -1.415974
O -1.425927 1.188001 -1.201272
O -6.157330 -1.045272 -0.598388
C 3.279632 1.397055 0.195749
C 3.535322 -0.016529 -0.347433
C 2.072008 1.478773 1.146025
C 2.213208 -0.531110 -0.997452
C 0.844956 0.894954 0.436766
C 2.282681 -1.973684 -1.497728
C -1.485943 0.305421 1.056064
C -2.137694 0.494673 -0.208702
C -2.173375 -0.337575 2.108184
C -3.443517 0.004699 -0.384133
C -3.485418 -0.810255 1.930491
C -4.125435 -0.647591 0.676928
C -5.501893 -1.147694 0.476793
C -2.103205 1.409776 -2.485080
H 3.094017 2.061505 -0.678122
H 3.816882 -0.699551 0.481265
H 2.280730 0.886306 2.060574
H 1.983908 0.121893 -1.872898
H 0.532400 1.500681 -0.433305
H 5.225426 1.828851 0.377559
H 4.768743 -0.728029 -1.758039
H 2.635435 3.269442 1.803459
H -1.641463 -0.456231 3.056233
H 3.562835 -3.138246 -2.477258
H -3.981543 0.116581 -1.330877
H -4.008137 -1.310970 2.753537
H -5.952204 -1.644786 1.373351
H -3.029469 1.998315 -2.347447
H -2.338348 0.449695 -2.981537
H -1.385678 1.981200 -3.091895


