%chk=000125990.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000125990

0 1
 O   0.6001000       2.544300      0.3246000    
 O    2.437400       5.179000      -1.116300    
 O    6.148900     -0.3416000     -0.8133000    
 O    4.895200      -2.453300      0.4893000    
 O   0.8809000       5.275500      0.5332000    
 O   -5.124900      -2.364100      0.3491000    
 O   -7.354600     -0.8194000      0.8330000    
 O  -0.4084000       3.462600      -1.540100    
 O    1.446300      -3.530100      -2.600200    
 O    2.707000      -4.820000     -0.4863000    
 C    2.890200       2.794900       1.022300    
 C    1.853100       3.124500     -5.3500000E-02
 C    3.429300       1.391800      0.8772000    
 C    4.549500       1.172700      9.1700003E-02
 C    2.793600      0.3496000       1.532600    
 C   -3.877600     -0.3916000     -0.2131000    
 C   -3.815300      0.9866000     -0.3724000    
 C    1.648700       4.622200     -0.1611000    
 C    5.047600     -0.1234000     -4.1800000E-02
 C    3.291500     -0.9465000       1.398800    
 C    4.418500      -1.183000      0.6117000    
 C   -5.054500      -1.009900      0.1898000    
 C   -2.598800       1.673300     -0.7937000    
 C   -4.949400       1.760200     -0.1250000    
 C   -2.689800      -1.224900     -0.4699000    
 C  -0.4392000       2.799800     -0.5153000    
 C   -6.188600     -0.2363000      0.4372000    
 C   -1.636600       2.125800      3.6300000E-02
 C   -6.135900       1.148600      0.2797000    
 C   -1.775100      -1.587900      0.4603000    
 C  -0.6130000      -2.426100      0.2113000    
 C  -0.1303000      -2.581200      -1.088200    
 C   1.9200001E-02  -3.074900       1.272100    
 C   0.9845000      -3.384800      -1.327000    
 C    1.134000      -3.878600       1.033200    
 C    1.616700      -4.033600     -0.2662000    
 H    2.456400       2.914400       2.024200    
 H    3.729200       3.501700      0.9743000    
 H    2.142400       2.724000      -1.033500    
 H    5.035100       2.000900     -0.4178000    
 H    1.917700      0.5234000       2.151100    
 H    2.811300      -1.761000       1.930200    
 H   -2.509300       1.819900      -1.867800    
 H   -4.927500       2.841200     -0.2431000    
 H   -2.622400      -1.560300      -1.501200    
 H   -1.690800       1.969300       1.108700    
 H   -7.012000       1.763300      0.4688000    
 H   -1.909500      -1.247100       1.485100    
 H  -0.5808000      -2.076300      -1.938200    
 H  -0.3426000      -2.965900       2.291600    
 H    2.308400       6.149500      -1.176700    
 H    6.447900      0.5055000      -1.186000    
 H    1.617500      -4.377700       1.868800    
 H    5.675300      -2.432500     -9.1799997E-02
 H   -6.026300      -2.595200      0.6333000    
 H   -8.028500     -0.1290000      0.9563000    
 H    2.221800      -4.117300      -2.579300    
 H    3.013800      -5.180900      0.3632000    


%chk=000125990-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000125990

0 1
O 0.555274 3.069045 0.847423
O 3.156241 5.626977 0.859983
O 3.387383 -0.906872 -1.965044
O 4.806195 -2.376723 -0.246519
O 0.840623 5.797997 0.942037
O -5.704657 -2.322018 -0.797214
O -7.638230 -0.501611 -0.435917
O 0.406353 2.228760 -1.337558
O 1.073908 -5.306548 -1.690666
O 3.111952 -4.562909 -0.061015
C 2.954276 2.843198 1.444625
C 1.912953 3.579727 0.574915
C 3.388085 1.451842 0.975548
C 3.113561 0.953041 -0.322674
C 4.163740 0.652345 1.857011
C -3.947422 -0.665626 -0.507943
C -3.588682 0.720838 -0.309536
C 1.858000 5.091556 0.830649
C 3.601605 -0.307932 -0.706091
C 4.662931 -0.612271 1.465166
C 4.376839 -1.093790 0.177764
C -5.325362 -0.995454 -0.574257
C -2.195120 1.147218 -0.502093
C -4.602435 1.687827 -0.068089
C -2.934914 -1.728020 -0.581004
C -0.142746 2.460603 -0.224786
C -6.317224 -0.005823 -0.363895
C -1.515269 2.130681 0.173437
C -5.966206 1.331427 -0.090021
C -1.775860 -1.657984 0.156186
C -0.591756 -2.517760 0.148166
C -0.385778 -3.598072 -0.760485
C 0.448298 -2.180355 1.062979
C 0.844301 -4.274050 -0.776151
C 1.679745 -2.859581 1.050164
C 1.894557 -3.877514 0.103797
H 2.549922 2.779961 2.472839
H 3.848795 3.491752 1.497158
H 2.132176 3.449504 -0.504911
H 2.485581 1.514118 -1.024269
H 4.390293 1.023097 2.863588
H 5.265742 -1.220480 2.146456
H -1.638538 0.617425 -1.288873
H -4.318574 2.736249 0.063763
H -3.166917 -2.603699 -1.199196
H -1.918014 2.638081 1.054888
H -6.741747 2.090184 0.069698
H -1.700913 -0.821554 0.864771
H -1.153667 -3.891988 -1.482485
H 0.291816 -1.359493 1.771880
H 3.099875 6.615638 0.961757
H 2.696880 -0.436381 -2.490936
H 2.476989 -2.577993 1.745182
H 4.642271 -2.432383 -1.227928
H -6.696958 -2.377472 -0.790238
H -8.309482 0.194470 -0.240091
H 2.008308 -5.624850 -1.563041
H 3.878303 -3.956254 0.171298


