%chk=000061405.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000061405

0 1
 O   -3.435900     -0.2271000     -0.2664000    
 O   -2.142600       1.459200      0.6317000    
 C    2.717400     -0.3989000      0.3000000    
 C    3.839800      -1.412200      3.7599999E-02
 C    2.990800      0.9213000     -0.4332000    
 C    5.210200     -0.8397000      0.3923000    
 C    4.362700       1.489800     -7.7900000E-02
 C    1.363800     -0.9746000     -0.1121000    
 C    5.474700      0.4768000     -0.3317000    
 C   0.2338000      7.8999996E-03  0.1790000    
 C   -1.121900     -0.5857000     -0.2002000    
 C   -2.261200      0.3564000      0.1160000    
 C   -4.615300      0.5479000     -2.8200001E-02
 C   -5.801400     -0.2265000     -0.4990000    
 C   -6.815100     -0.5947000      0.2920000    
 H    2.693000     -0.1934000       1.379200    
 H    3.836100      -1.708700      -1.019100    
 H    3.666500      -2.322800      0.6235000    
 H    2.255600       1.686600     -0.1672000    
 H    2.928200      0.7713000      -1.518400    
 H    5.990200      -1.564900      0.1346000    
 H    5.269000     -0.6789000       1.475800    
 H    4.373200       1.785700      0.9784000    
 H    4.549700       2.396100     -0.6650000    
 H    1.368100      -1.225200      -1.180500    
 H    1.184300      -1.909900      0.4328000    
 H    6.434300      0.8921000     -3.5000001E-03
 H    5.558900      0.2900000      -1.409300    
 H   0.3528000      0.9332000     -0.3934000    
 H   0.2378000      0.2810000       1.241400    
 H   -1.287600      -1.515500      0.3556000    
 H   -1.143600     -0.8022000      -1.274200    
 H   -4.688100      0.7792000       1.041000    
 H   -4.553300       1.485300     -0.5927000    
 H   -5.835200     -0.4989000      -1.550500    
 H   -7.650800      -1.155700     -0.1118000    
 H   -6.831000     -0.3466000       1.347500    


%chk=000061405-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000061405

0 1
O -3.520458 -0.339044 -0.116427
O -2.322756 1.646900 -0.359845
C 2.735116 -0.329757 0.195204
C 3.839352 -1.398290 -0.022454
C 3.184749 1.028325 -0.407293
C 5.210246 -0.947903 0.534069
C 4.556417 1.485058 0.145743
C 1.380642 -0.819104 -0.377340
C 5.643961 0.407146 -0.073887
C 0.175019 0.084960 -0.037287
C -1.157491 -0.535507 -0.511230
C -2.344142 0.394919 -0.324023
C -4.779595 0.467400 0.023823
C -5.934070 -0.477330 -0.153671
C -6.951988 -0.603781 0.732840
H 2.613930 -0.189383 1.293489
H 3.935309 -1.596142 -1.111712
H 3.532535 -2.353776 0.448870
H 2.425452 1.808877 -0.208385
H 3.252327 0.920973 -1.511547
H 5.976375 -1.722112 0.332633
H 5.140791 -0.845218 1.637239
H 4.460727 1.687748 1.232997
H 4.858124 2.438120 -0.331040
H 1.468636 -0.915212 -1.481160
H 1.184261 -1.842051 0.008934
H 6.605808 0.736041 0.365798
H 5.814942 0.279216 -1.163315
H 0.287051 1.081624 -0.500951
H 0.133697 0.250941 1.057820
H -1.368268 -1.492002 -0.001125
H -1.090452 -0.767756 -1.594758
H -4.780709 0.949791 1.017251
H -4.758846 1.260578 -0.748181
H -5.930049 -1.064090 -1.082320
H -7.795547 -1.276239 0.543809
H -6.973199 -0.036222 1.671533


