%chk=000155448.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000155448

0 1
 O    2.726900      0.8015000     -0.3336000    
 O    1.095600     -0.8662000     -0.3779000    
 O    5.751400      -1.976800     -0.3255000    
 O    6.304700      0.7530000      0.4476000    
 O    3.025700      -2.746600      0.4860000    
 O    3.104200       3.494800      6.5899998E-02
 C    4.784900      -1.109200      0.2691000    
 C    5.097300      0.3204000     -0.1736000    
 C    3.383000      -1.531100     -0.1713000    
 C    3.960700       1.269500      0.2139000    
 C    2.344100     -0.4689000      0.1881000    
 C    4.195400       2.679100     -0.3200000    
 C   3.7000000E-03 -0.2189000      0.2595000    
 C   -1.308300     -0.6727000     -0.3689000    
 C   -2.522100      1.0500000E-02  0.2679000    
 C   -3.825100     -0.4408000     -0.3968000    
 C   -5.039200      0.2199000      0.2592000    
 C   -6.375200     -0.2207000     -0.3469000    
 C   -7.629500      0.3913000      0.2844000    
 C   -8.932500     -0.1280000     -0.3239000    
 C   -10.14570      0.4400000      0.3967000    
 H    4.904100      -1.217300       1.353500    
 H    5.261200      0.3429000      -1.258000    
 H    3.364400      -1.736700      -1.248100    
 H    3.855500       1.333800       1.305500    
 H    2.241200     -0.4061000       1.280600    
 H    5.116900       3.112300      8.0700003E-02
 H    4.240900       2.679200      -1.414100    
 H   7.9999998E-04 -0.4689000       1.327200    
 H   0.1089000      0.8673000      0.1546000    
 H   -1.395600      -1.762500     -0.2763000    
 H   -1.281300     -0.4653000      -1.446100    
 H   -2.421200       1.098700      0.1768000    
 H   -2.552600     -0.2242000       1.338700    
 H   -3.802800     -0.1901000      -1.464100    
 H   -3.917800      -1.530900     -0.3219000    
 H    5.658600      -1.916300      -1.291600    
 H    6.165300      0.7497000       1.410000    
 H    3.036000      -2.585300       1.444900    
 H   -5.043500     -1.3100000E-02   1.331300    
 H   -4.951300       1.309900      0.1729000    
 H   -6.445600      -1.313600     -0.2737000    
 H   -6.370900      1.6600000E-02  -1.418400    
 H   -7.621800      0.1757000       1.360100    
 H   -7.587400       1.482400      0.1809000    
 H    3.272300       4.385000     -0.2874000    
 H   -8.979100      0.1408000      -1.385400    
 H   -8.960500      -1.222200     -0.2641000    
 H   -11.06710      5.9500001E-02 -5.5199999E-02
 H   -10.14350      0.1556000       1.453900    
 H   -10.16260       1.532800      0.3344000    


%chk=000155448-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000155448

0 1
O 2.761736 0.938598 -0.263259
O 1.121400 -0.771086 -0.235977
O 5.854161 -1.894725 -0.345086
O 6.444512 0.823799 0.324543
O 3.169174 -2.762864 0.324184
O 3.503850 3.692502 0.659082
C 4.817483 -1.023769 0.220655
C 5.157141 0.404330 -0.233346
C 3.413761 -1.428560 -0.235579
C 4.072094 1.385461 0.268851
C 2.399007 -0.389308 0.271875
C 4.308333 2.811920 -0.202452
C -0.011309 0.018566 0.312131
C -1.300564 -0.576635 -0.254996
C -2.562061 0.145300 0.272906
C -3.870429 -0.455389 -0.288692
C -5.142631 0.232273 0.255426
C -6.449322 -0.373108 -0.305391
C -7.725471 0.295699 0.253423
C -9.030899 -0.311742 -0.309419
C -10.301816 0.355425 0.259695
H 4.852545 -1.070551 1.331924
H 5.189816 0.417409 -1.344469
H 3.353323 -1.444419 -1.343483
H 4.058790 1.376892 1.380468
H 2.393226 -0.338250 1.389293
H 5.389833 3.033372 -0.104664
H 4.002278 2.897330 -1.266221
H 0.008748 -0.047245 1.422018
H 0.118310 1.076417 0.016918
H -1.348135 -1.652027 0.006932
H -1.265365 -0.515969 -1.359794
H -2.511800 1.222760 0.012231
H -2.583971 0.092817 1.381616
H -3.859800 -0.385209 -1.396323
H -3.908604 -1.538078 -0.046355
H 5.609581 -2.831762 -0.133296
H 7.086914 0.086191 0.153810
H 2.248006 -3.029428 0.073314
H -5.152339 0.160374 1.363331
H -5.107298 1.315453 0.014971
H -6.476428 -1.459402 -0.077069
H -6.446558 -0.289084 -1.412474
H -7.730698 0.209455 1.360395
H -7.701141 1.382404 0.027281
H 3.637715 4.631740 0.377755
H -9.027366 -0.220859 -1.414968
H -9.051102 -1.398448 -0.087631
H -11.220081 -0.095848 -0.159376
H -10.345323 0.250162 1.360348
H -10.319726 1.436916 0.026443


