%chk=000097213.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000097213

0 1
 O    1.236600      -1.754800      0.5690000    
 O   -1.552700      -1.342700      0.4624000    
 O    2.137900      -3.273500     -0.8287000    
 O   -3.826000      -1.655500      0.3083000    
 C   0.6883000     -0.4077000      0.7765000    
 C    1.738900      0.6606000      0.3788000    
 C  -0.6204000     -0.3585000     -4.3200001E-02
 C    1.276200       2.131600      0.5491000    
 C   -1.393000      0.9573000     -2.7100001E-02
 C   0.4238000       2.716500     -0.5905000    
 C  -0.8377000       1.966500      -1.027800    
 C    2.283100      0.3537000      -1.018900    
 C   0.4117000     -0.3656000       2.293000    
 C   -2.762600      0.4261000     -0.3135000    
 C    2.907200      -1.025500      -1.039100    
 C    2.496700       3.048400      0.7570000    
 C    2.034800      -2.104700     -0.4647000    
 C   -2.830200     -0.9694000      0.1688000    
 C   -3.812500      0.9972000     -0.9093000    
 H    2.586600      0.5143000       1.066300    
 H  -0.4072000     -0.6773000      -1.073300    
 H   0.6968000       2.215500       1.475100    
 H   -1.433100       1.395100      0.9770000    
 H    1.046700       2.886000      -1.478800    
 H   0.1080000       3.721700     -0.2760000    
 H   -1.594400       2.726700      -1.258500    
 H  -0.6399000       1.467200      -1.985500    
 H    3.042400       1.086700      -1.312400    
 H    1.492700      0.4023000      -1.774300    
 H    1.350700     -0.4278000       2.855700    
 H  -0.1137000      0.5383000       2.609300    
 H  -0.1809000      -1.230600       2.613200    
 H    3.843300      -1.025400     -0.4689000    
 H    3.146100      -1.291000      -2.075100    
 H    3.097400       2.711700       1.608600    
 H    3.141900       3.074400     -0.1267000    
 H    2.177400       4.075000      0.9680000    
 H   -3.771900       2.019400      -1.267500    
 H   -4.746800      0.4640000      -1.052200    


%chk=000097213-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000097213

0 1
O 1.246446 -1.822412 0.560076
O -1.597231 -1.384899 0.471030
O 2.504336 -3.344817 -0.567658
O -3.914257 -1.645257 0.384348
C 0.675981 -0.427405 0.782694
C 1.720900 0.648607 0.350592
C -0.619551 -0.379005 -0.057711
C 1.259335 2.131847 0.543344
C -1.402924 0.967631 -0.085633
C 0.425342 2.746903 -0.620520
C -0.839100 1.973761 -1.107416
C 2.263371 0.353094 -1.068292
C 0.390496 -0.423065 2.292110
C -2.826262 0.478366 -0.316062
C 2.980238 -1.008328 -1.088612
C 2.490790 3.036038 0.804947
C 2.231299 -2.142441 -0.389439
C -2.915566 -0.932827 0.194827
C -3.895377 1.116025 -0.849565
H 2.568486 0.501329 1.054628
H -0.394818 -0.691701 -1.096214
H 0.642411 2.173279 1.463540
H -1.375300 1.415785 0.928946
H 1.094187 2.920837 -1.486101
H 0.115172 3.753366 -0.276904
H -1.622251 2.712319 -1.361141
H -0.626734 1.428985 -2.048112
H 2.973170 1.142654 -1.376169
H 1.445517 0.362068 -1.811903
H 1.339457 -0.457805 2.853500
H -0.170897 0.473287 2.608665
H -0.203942 -1.312644 2.550884
H 3.958055 -0.927694 -0.572349
H 3.201707 -1.349697 -2.114607
H 3.039856 2.714248 1.708590
H 3.196555 3.016049 -0.046738
H 2.183957 4.087559 0.954050
H -3.841794 2.143792 -1.224680
H -4.858860 0.598366 -0.916846


