%chk=000147320.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000147320

0 1
 O   -4.936300      -1.116600     -0.6386000    
 O    4.942200     -0.1323000      -1.707900    
 C  -0.5020000      0.8228000      0.4494000    
 C   0.3933000     -0.4278000      0.1680000    
 C   -1.783500      0.7040000     -0.3824000    
 C   -2.597100     -0.5602000     -4.2700000E-02
 C    1.754200     -0.3621000      0.9540000    
 C    2.485200      0.9817000      0.6168000    
 C  -0.3895000      -1.755200      0.3582000    
 C   -1.738300      -1.784400     -0.3842000    
 C   0.2466000       2.126800      0.1435000    
 C   -2.819700       1.822900     -0.3171000    
 C   -3.804400     -0.3378000     -0.9748000    
 C    1.589200       2.207100      0.8661000    
 C   -4.111200       1.165700     -0.8365000    
 C    2.711600      -1.538500      0.6022000    
 C   -3.065700     -0.6526000       1.431800    
 C    1.519800     -0.4488000       2.485400    
 C    3.041900       1.024200     -0.8190000    
 C    3.208700      -1.532800     -0.8344000    
 C    3.854900     -0.2062000      -1.137800    
 H  -0.7742000      0.8491000       1.509600    
 H   0.6331000     -0.3923000     -0.9038000    
 H   -1.470400      0.6428000      -1.438500    
 H    3.352100       1.070300       1.288300    
 H  -0.5629000      -1.947800       1.421300    
 H   0.2070000      -2.595400     -1.3800000E-02
 H   -1.540100      -1.815300      -1.463500    
 H   -2.272300      -2.711400     -0.1428000    
 H  -0.3636000       2.985900      0.4471000    
 H   0.3995000       2.227700     -0.9375000    
 H   -2.535100       2.682600     -0.9324000    
 H   -2.959600       2.180700      0.7090000    
 H   -3.540200     -0.5636000      -2.015000    
 H    2.110900       3.121100      0.5562000    
 H    1.409200       2.317400       1.942100    
 H   -4.947500       1.366800     -0.1577000    
 H   -4.391000       1.579900      -1.811800    
 H    2.243400      -2.504700      0.8204000    
 H    3.590900      -1.483300       1.260500    
 H   -3.722800      0.1754000       1.716000    
 H   -3.621700      -1.581700       1.603300    
 H   -2.233000     -0.6505000       2.140100    
 H   0.8243000      0.3074000       2.856400    
 H    1.126700      -1.428300       2.776800    
 H    2.460800     -0.3103000       3.031200    
 H    3.687000       1.903100     -0.9358000    
 H    2.253000       1.096000      -1.573800    
 H    2.399900      -1.705200      -1.550500    
 H    3.951000      -2.326900     -0.9700000    
 H   -5.310900     -0.7856000      0.1944000    


%chk=000147320-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000147320

0 1
O -4.982346 -1.211104 -0.780370
O 5.005152 -0.161753 -1.754553
C -0.490973 0.838438 0.476350
C 0.405330 -0.418738 0.195063
C -1.785930 0.716466 -0.351262
C -2.605070 -0.572436 -0.040626
C 1.773558 -0.355165 0.976001
C 2.517070 0.985623 0.622265
C -0.379052 -1.747571 0.401998
C -1.722679 -1.795210 -0.376593
C 0.269127 2.147164 0.155479
C -2.836071 1.859621 -0.301745
C -3.822673 -0.336153 -0.990967
C 1.628952 2.230208 0.884953
C -4.144813 1.190129 -0.842289
C 2.718834 -1.542366 0.606468
C -3.112943 -0.651008 1.422768
C 1.554052 -0.431824 2.514260
C 3.066501 1.015363 -0.840621
C 3.195579 -1.551007 -0.869999
C 3.867288 -0.226473 -1.215181
H -0.762463 0.856525 1.552977
H 0.644926 -0.370631 -0.892286
H -1.467809 0.622903 -1.417062
H 3.400478 1.045983 1.294158
H -0.574584 -1.906362 1.480015
H 0.243949 -2.601524 0.073700
H -1.513082 -1.797775 -1.467419
H -2.256401 -2.739343 -0.152616
H -0.352884 3.019176 0.436035
H 0.418094 2.217294 -0.942677
H -2.533357 2.729897 -0.909862
H -2.971259 2.221439 0.735719
H -3.520238 -0.571156 -2.028257
H 2.173518 3.143523 0.572422
H 1.452467 2.330816 1.973930
H -4.987710 1.327588 -0.136551
H -4.467954 1.620174 -1.805844
H 2.232930 -2.507434 0.841841
H 3.613454 -1.482140 1.260228
H -3.751767 0.211038 1.692092
H -3.703614 -1.575743 1.562677
H -2.285608 -0.679783 2.151246
H 0.838381 0.321556 2.884421
H 1.177583 -1.427009 2.813474
H 2.512019 -0.270378 3.044254
H 3.702210 1.906330 -0.990356
H 2.220152 1.091977 -1.553426
H 2.325434 -1.692752 -1.543636
H 3.904531 -2.375519 -1.059755
H -5.426889 -0.947069 0.064957


