%chk=000017150.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017150

0 1
 O   -5.304900       1.241100     -0.1450000    
 O   0.1932000       2.558700     -0.1148000    
 O    5.078000     -0.7597000       1.229400    
 O    5.595800       1.871200      0.7336000    
 C   -2.954600      0.5068000     -0.2086000    
 C   -2.284600     -0.7440000      0.3932000    
 C  -0.9534000      -1.091100     -0.2836000    
 C   5.1199999E-02  0.1095000     -0.1330000    
 C   -4.307900      0.5132000      0.5690000    
 C   -2.011100       1.688500      3.5599999E-02
 C   -3.398700      -1.787400      0.3747000    
 C  -0.6060000       1.462500     -0.5624000    
 C    1.447200     -0.2281000     -0.8137000    
 C   -4.690000     -0.9883000      0.6244000    
 C  -0.3596000      -2.384400      0.2975000    
 C   -3.232500      0.3956000      -1.735300    
 C   0.9785000      -2.728200     -0.3450000    
 C    1.927400      -1.562900     -0.2295000    
 C   -4.254700       1.110200       1.981300    
 C    1.329200     -0.3580000      -2.350900    
 C    2.480900      0.8683000     -0.5825000    
 C    3.092400      -1.719400      0.4177000    
 C    3.645300      0.7207000      6.3000001E-02
 C    4.025900     -0.5939000      0.6207000    
 C    4.513000       1.899100      0.1642000    
 H   -2.052500     -0.5544000       1.452300    
 H   -1.140600      -1.276900      -1.346200    
 H   0.2625000      0.2155000      0.9445000    
 H   -1.887300       1.875200       1.110000    
 H   -2.439900       2.615100     -0.3676000    
 H   -3.253100      -2.552200       1.144600    
 H   -3.451900      -2.300000     -0.5925000    
 H  -0.6551000       1.523600      -1.653400    
 H   -5.441000      -1.242300     -0.1331000    
 H   -5.121900      -1.259200       1.594700    
 H   -1.047600      -3.222900      0.1384000    
 H  -0.2317000      -2.281200       1.383100    
 H   -3.927100     -0.4159000      -1.974900    
 H   -3.675000       1.323800      -2.115700    
 H   -2.328500      0.2204000      -2.323900    
 H   0.8374000      -2.991600      -1.399300    
 H    1.382300      -3.625300      0.1402000    
 H   -4.025600       2.181100       1.949700    
 H   -5.236900       1.031700       2.462900    
 H   -3.524900      0.6138000       2.626500    
 H   0.5796000      -1.090500      -2.662800    
 H    1.059500      0.5951000      -2.820200    
 H    2.282800     -0.6732000      -2.794600    
 H    2.259300       1.834400      -1.030800    
 H   -5.006200       2.164100     -0.2139000    
 H  -0.2100000       3.375600     -0.4551000    
 H    3.387400      -2.675800      0.8372000    
 H    4.139000       2.827100     -0.3003000    


%chk=000017150-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000017150

0 1
O -5.444819 1.195428 -0.106219
O 0.255616 2.557299 -0.526790
O 5.257414 -0.953229 1.169192
O 5.649252 1.998717 0.962991
C -2.984606 0.504064 -0.245749
C -2.285599 -0.746378 0.367067
C -0.949586 -1.102731 -0.320614
C 0.042841 0.112109 -0.171538
C -4.319677 0.543258 0.606830
C -2.007825 1.690729 -0.099259
C -3.414962 -1.806717 0.425474
C -0.631586 1.390446 -0.752791
C 1.494391 -0.224593 -0.769670
C -4.702756 -0.970870 0.727017
C -0.357328 -2.405279 0.255477
C -3.369152 0.310156 -1.739451
C 0.988782 -2.750948 -0.424357
C 1.949273 -1.595231 -0.255372
C -4.174084 1.216364 1.988395
C 1.448573 -0.258269 -2.341782
C 2.488106 0.858847 -0.405570
C 3.157449 -1.773184 0.360010
C 3.702322 0.675980 0.212245
C 4.138630 -0.695949 0.625397
C 4.517715 1.908979 0.429869
H -2.026713 -0.489279 1.419183
H -1.140385 -1.280438 -1.400395
H 0.189893 0.288506 0.916096
H -1.821121 1.921134 0.967790
H -2.424965 2.608206 -0.571004
H -3.229679 -2.573126 1.198104
H -3.502774 -2.336266 -0.542059
H -0.767668 1.265696 -1.846847
H -5.510825 -1.180297 0.005748
H -5.103533 -1.186687 1.733048
H -1.073769 -3.234369 0.106145
H -0.203173 -2.298672 1.348661
H -4.105586 -0.499207 -1.871681
H -3.841036 1.228810 -2.128874
H -2.494677 0.081275 -2.372621
H 0.801622 -2.952617 -1.499503
H 1.421614 -3.671004 0.006747
H -3.937714 2.294991 1.901275
H -5.127959 1.121611 2.536666
H -3.382910 0.748922 2.601307
H 0.657977 -0.937006 -2.706336
H 1.258087 0.749977 -2.748183
H 2.415618 -0.608658 -2.741507
H 2.180346 1.873002 -0.689718
H -5.346274 2.179180 -0.028534
H -0.259415 3.382362 -0.716851
H 3.465382 -2.769661 0.701780
H 3.994252 2.829716 0.050560


