%chk=000122238.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122238

0 1
 O   -1.951600      -1.719000      0.6433000    
 O    1.827300      -4.201400     -0.6715000    
 O   0.1155000      0.6848000     -0.9182000    
 O    6.224400      -1.370800     -0.4365000    
 O   -8.725100       1.166300      0.1918000    
 O   -6.981100       2.586500      0.5182000    
 C   0.4319000      -1.100200      0.6882000    
 C    1.573700      -1.866000      6.2000002E-03
 C  -0.6423000      -2.149300       1.044700    
 C    1.291800      -3.341400      0.3188000    
 C  -0.2271000      -3.418300      0.3085000    
 C  -0.3379000     -0.2216000     -0.2417000    
 C    2.923100      -1.438200      0.4882000    
 C   -1.749900     -0.6329000     -0.1816000    
 C    3.885800     -0.9609000     -0.3142000    
 C   -2.725300     -1.7300000E-02 -0.8523000    
 C    5.241200     -0.5333000      0.1747000    
 C   -4.170500     -0.4253000     -0.8010000    
 C    5.578900      0.9176000     -0.1947000    
 C    4.546900       1.926900      0.3170000    
 C   -5.056500      0.7288000     -0.3215000    
 C    4.838800       3.367000     -0.1171000    
 C   -6.532900      0.3465000     -0.2669000    
 C    3.850500       4.386800      0.4503000    
 C    4.178200       5.796400     -1.8800000E-02
 C   -7.407700       1.488300      0.1862000    
 H   0.7272000     -0.5215000       1.570200    
 H    1.525500      -1.723400      -1.083200    
 H  -0.6509000      -2.329700       2.126600    
 H    1.690300      -3.634900       1.298000    
 H  -0.6239000      -3.447800     -0.7143000    
 H  -0.5971000      -4.320700      0.8064000    
 H    3.118600      -1.522800       1.554900    
 H    1.541100      -5.106000     -0.4585000    
 H    3.699200     -0.8784000      -1.382400    
 H   -2.486000      0.8291000      -1.491900    
 H    5.330500     -0.6575000       1.260400    
 H   -4.320700      -1.294500     -0.1505000    
 H   -4.478500     -0.7278000      -1.809100    
 H    6.572600       1.166700      0.1994000    
 H    5.668100       1.005700      -1.286000    
 H    4.513600       1.878400       1.412400    
 H    3.545300       1.664700     -4.2900000E-02
 H   -4.928500       1.593200     -0.9865000    
 H   -4.727700       1.054600      0.6743000    
 H    4.826100       3.418800      -1.212900    
 H    5.854000       3.636300      0.2003000    
 H    6.041800      -2.286600     -0.1643000    
 H   -6.869600      3.7000000E-02  -1.262600    
 H   -6.674800     -0.4866000      0.4304000    
 H    3.872600       4.355300       1.545600    
 H    2.831900       4.129400      0.1378000    
 H    5.180700       6.094500      0.3045000    
 H    4.133400       5.867100      -1.110400    
 H    3.460700       6.510300      0.3975000    
 H   -9.283800       1.915300      0.4902000    


%chk=000122238-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122238

0 1
O -1.693782 -1.806994 0.645965
O 1.797304 -4.504908 -0.247657
O 0.550790 1.002214 0.451742
O 5.817120 -1.138943 -1.744253
O -8.480735 1.173193 -0.876736
O -7.030758 2.668764 0.148657
C 0.606018 -1.344882 1.302379
C 1.544293 -2.142820 0.321784
C -0.591327 -2.290781 1.565896
C 1.354789 -3.600649 0.815486
C -0.158730 -3.714614 1.157724
C -0.012289 -0.107353 0.643075
C 2.962092 -1.639440 0.322659
C -1.399891 -0.484835 0.238942
C 3.578443 -1.053354 -0.734655
C -2.281509 0.304258 -0.438341
C 4.981328 -0.494739 -0.696924
C -3.683441 -0.087040 -0.826291
C 5.036268 1.015001 -0.997471
C 4.346897 1.881730 0.079430
C -4.732053 0.973915 -0.399172
C 4.416540 3.392293 -0.238382
C -6.148957 0.576575 -0.853604
C 3.707419 4.263759 0.823243
C 3.765543 5.772839 0.501886
C -7.204642 1.591305 -0.460284
H 1.159155 -1.070287 2.216382
H 1.130830 -2.098149 -0.705617
H -0.990943 -2.214921 2.592030
H 1.963104 -3.759768 1.734704
H -0.711597 -4.003246 0.245215
H -0.367099 -4.461367 1.943478
H 3.505604 -1.729889 1.278542
H 1.750988 -5.440156 0.073710
H 3.053525 -0.949491 -1.696313
H -1.913025 1.303182 -0.708767
H 5.426222 -0.687183 0.305538
H -3.929638 -1.072085 -0.388599
H -3.735268 -0.207397 -1.930858
H 6.103458 1.297459 -1.091206
H 4.570200 1.192712 -1.986937
H 4.825017 1.697084 1.065332
H 3.285109 1.582825 0.183736
H -4.469196 1.960222 -0.825798
H -4.712971 1.098012 0.698856
H 3.952407 3.578354 -1.229635
H 5.477561 3.708529 -0.326619
H 5.695938 -2.120950 -1.674854
H -6.194438 0.450134 -1.953573
H -6.444777 -0.403060 -0.429852
H 4.169891 4.077906 1.814682
H 2.650702 3.939148 0.907247
H 4.812661 6.125985 0.440361
H 3.282253 5.988683 -0.469885
H 3.250985 6.372926 1.275196
H -9.151586 1.858491 -0.608092


