%chk=000050160.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050160

0 1
 O   -4.111300      -1.477700      0.7134000    
 O   -3.826300      0.9538000       1.801100    
 O   -2.797000       1.828400      -1.582600    
 C   -4.376200     -0.3579000     -0.1403000    
 C   -3.315100      -1.371700     -0.4761000    
 C   -3.946600      0.9784000      0.3784000    
 C   -1.875100     -0.9729000     -0.3088000    
 C   -2.605000       1.437900     -0.2248000    
 C   -1.496800      0.3881000     -0.2012000    
 C  -0.1180000      0.7524000     -0.1146000    
 C  -0.8780000      -1.955900     -0.2661000    
 C   0.8626000     -0.2724000     -7.6200001E-02
 C   0.4757000      -1.629000     -0.1442000    
 C    2.245900      4.4399999E-02  2.6699999E-02
 C   0.3439000       2.086600     -6.9700003E-02
 C    2.663600       1.391800      8.2400002E-02
 C    1.449200      -2.636000     -9.9799998E-02
 C    3.216600     -0.9857000      7.1699999E-02
 C    1.701600       2.400800      2.9100001E-02
 C    2.802000      -2.319400      9.1000004E-03
 C    4.029600       1.694600      0.1850000    
 C    4.575900     -0.6552000      0.1755000    
 C    4.978700      0.6767000      0.2321000    
 H   -5.295600     -0.3468000     -0.7075000    
 H   -3.547400      -2.063000      -1.280300    
 H   -4.719300       1.716200      0.1311000    
 H   -2.297200       2.322800      0.3405000    
 H   -1.176400      -3.002000     -0.3362000    
 H   -4.690100      0.6887000       2.161000    
 H  -0.3474000       2.923900     -0.1189000    
 H   -2.996800       1.034300      -2.106900    
 H    1.163400      -3.685000     -0.1514000    
 H    1.993600       3.448500      6.1900001E-02
 H    3.528100      -3.129000      4.0800001E-02
 H    4.366600       2.728100      0.2286000    
 H    5.334700      -1.434000      0.2119000    
 H    6.033800      0.9216000      0.3115000    


%chk=000050160-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000050160

0 1
O -4.202603 -1.420813 0.866410
O -4.026286 1.108144 1.768753
O -2.767801 2.014057 -1.613781
C -4.433172 -0.347291 -0.182771
C -3.354335 -1.357203 -0.421581
C -4.015508 1.049621 0.305317
C -1.922169 -0.972461 -0.269816
C -2.624438 1.478295 -0.228240
C -1.552013 0.400951 -0.174222
C -0.166373 0.749534 -0.092211
C -0.941787 -1.987982 -0.255461
C 0.833935 -0.293041 -0.061283
C 0.434666 -1.678141 -0.135410
C 2.229974 0.037638 0.035333
C 0.285316 2.127179 -0.060655
C 2.644250 1.417097 0.088087
C 1.450023 -2.709102 -0.096622
C 3.224115 -1.007980 0.074856
C 1.628254 2.443857 0.028604
C 2.790215 -2.387263 0.008201
C 4.027927 1.725881 0.186005
C 4.597394 -0.656705 0.174728
C 4.992483 0.697082 0.230905
H -5.391599 -0.445253 -0.702870
H -3.563082 -2.216174 -1.071404
H -4.737296 1.803181 -0.050882
H -2.337129 2.351419 0.378347
H -1.251016 -3.037964 -0.328193
H -3.896276 0.172076 2.091157
H -0.452654 2.930373 -0.129475
H -2.528517 1.299844 -2.257808
H 1.131320 -3.756507 -0.149542
H 1.945393 3.493043 0.049886
H 3.551106 -3.175736 0.040804
H 4.340717 2.775640 0.225779
H 5.351710 -1.451431 0.207150
H 6.055159 0.950537 0.308105


