%chk=000005879.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000005879

0 1
 O    4.664200      4.2800002E-02  -1.729000    
 O   -4.926300      -1.111300     -0.8075000    
 C   0.2167000     -0.4415000     -0.1778000    
 C    1.693600     -0.4171000      0.3659000    
 C  -0.6115000      0.7866000      0.3292000    
 C   -2.010400      0.7044000     -0.2885000    
 C    2.324200      0.9469000     -6.2799998E-02
 C   -2.748700     -0.5806000      0.1393000    
 C  -0.5300000      -1.785300      4.5299999E-02
 C   8.5299999E-02   2.109600     -1.5799999E-02
 C   -1.991200      -1.770200     -0.4414000    
 C    1.533600       2.149100      0.4672000    
 C    2.535600      -1.551300     -0.2839000    
 C   -3.021000       1.817800     -3.5599999E-02
 C    3.816000       1.056200      0.2960000    
 C    1.716100     -0.6111000       1.904000    
 C   -4.101400     -0.2701000     -0.4759000    
 C    4.035100      -1.459300      2.7500000E-02
 C   -4.322300       1.228300     -0.5997000    
 C    4.626000     -9.2600003E-02 -0.3083000    
 C   -2.983700     -0.7514000       1.651600    
 H   0.2896000     -0.3332000      -1.272000    
 H  -0.7051000      0.7453000       1.419200    
 H   -1.869900      0.6800000      -1.383400    
 H    2.266300       1.003200      -1.160900    
 H  -0.5158000      -2.055300       1.105800    
 H  -1.1700000E-02  -2.591700     -0.4855000    
 H  -0.4588000       2.949300      0.4321000    
 H   6.6399999E-02   2.266000      -1.102100    
 H   -2.006800      -1.731000      -1.538500    
 H   -2.480500      -2.713000     -0.1679000    
 H    1.994200       3.080800      0.1164000    
 H    1.562900       2.183300       1.562200    
 H    2.401200      -1.527600      -1.373300    
 H    2.180700      -2.533600      4.9800001E-02
 H   -2.758500       2.749200     -0.5470000    
 H   -3.119400       2.040200       1.032300    
 H    4.202200       2.009100     -8.7700002E-02
 H    3.950800       1.076600       1.382900    
 H    2.721100     -0.5094000       2.322600    
 H    1.087500      0.1110000       2.430600    
 H    1.366600      -1.610700       2.182700    
 H    4.207600      -1.683400       1.086000    
 H    4.552700      -2.236000     -0.5488000    
 H   -4.443100       1.481200      -1.657000    
 H   -5.192100       1.546000     -2.0800000E-02
 H    5.661200     -4.5699999E-02  4.7499999E-02
 H   -2.053500     -0.8089000       2.222800    
 H   -3.579800      6.3299999E-02   2.076700    
 H   -3.542600      -1.675000       1.845600    
 H    5.064800      0.9055000      -1.930600    


%chk=000005879-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000005879

0 1
O 4.672347 -0.018496 -1.793852
O -4.983135 -1.188670 -0.883382
C 0.224839 -0.422318 -0.155976
C 1.705940 -0.409020 0.390486
C -0.608325 0.809661 0.345758
C -2.015854 0.723676 -0.277270
C 2.349750 0.959943 -0.043985
C -2.765267 -0.588485 0.099240
C -0.518532 -1.771597 0.080982
C 0.095294 2.140883 -0.012009
C -1.977460 -1.792383 -0.455696
C 1.557816 2.177118 0.481413
C 2.533791 -1.542131 -0.296561
C -3.061864 1.844361 -0.031104
C 3.852569 1.044684 0.308525
C 1.735173 -0.603497 1.932333
C -4.156715 -0.323134 -0.506972
C 4.047028 -1.483014 0.016259
C -4.375601 1.207596 -0.569327
C 4.664026 -0.113335 -0.312502
C -3.023614 -0.751201 1.632139
H 0.311684 -0.296096 -1.261650
H -0.703818 0.761601 1.451096
H -1.864095 0.680706 -1.382531
H 2.285030 0.981591 -1.155197
H -0.528818 -2.010941 1.161906
H 0.041218 -2.589358 -0.409692
H -0.472476 2.992062 0.412590
H 0.082677 2.266872 -1.116287
H -1.967091 -1.739142 -1.563177
H -2.470834 -2.745311 -0.186584
H 2.046684 3.112056 0.139404
H 1.582030 2.200085 1.590290
H 2.401402 -1.462291 -1.393705
H 2.150595 -2.534521 0.008395
H -2.809872 2.782488 -0.554550
H -3.144903 2.081136 1.046395
H 4.260067 2.015617 -0.045903
H 3.996909 1.034893 1.407897
H 2.756191 -0.496738 2.338404
H 1.097722 0.126514 2.461069
H 1.383983 -1.615029 2.205670
H 4.232039 -1.701338 1.085838
H 4.581717 -2.254936 -0.567842
H -4.554605 1.479153 -1.628151
H -5.288858 1.490882 -0.015604
H 5.712880 -0.076277 0.055971
H -2.079029 -0.857244 2.191143
H -3.572515 0.106141 2.061740
H -3.628820 -1.659481 1.803544
H 5.048806 0.861669 -2.049475


