%chk=000082528.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000082528

0 1
 O   -2.642700      0.7226000     -0.2619000    
 O   -4.786500       1.313800      0.3638000    
 C    1.148000      -1.743000      0.1183000    
 C  -0.2544000      -1.992600      0.6388000    
 C    1.363200      -2.002500      -1.356700    
 C    3.538800     -0.9778000      0.6409000    
 C    2.107000      -1.312800      0.9625000    
 C  -0.4268000      -3.411600       1.186900    
 C    1.022400     -0.7806000      -2.212500    
 C    3.887900      0.4754000      0.9869000    
 C  -5.9900001E-02   3.373800      0.3888000    
 C    1.444500       3.437900      0.1044000    
 C  -0.6512000       2.036300     -5.5500001E-02
 C    3.059600       1.465100      0.2154000    
 C    2.308700       2.415400      0.7923000    
 C   -1.832100      -3.629600       1.726800    
 C    1.271700      -1.048600      -3.688400    
 C   -2.153300       1.979900      0.1839000    
 C   -3.987000      0.5192000     -0.1121000    
 C   -4.357700     -0.8403000     -0.6226000    
 H  -0.9856000      -1.803800     -0.1568000    
 H  -0.4872000      -1.267800       1.430300    
 H    2.394800      -2.316800      -1.549600    
 H   0.7459000      -2.855900      -1.665900    
 H    4.185400      -1.644800       1.223500    
 H    3.777200      -1.158900     -0.4116000    
 H    1.837800      -1.175300       2.009400    
 H   0.2956000      -3.595900       1.991000    
 H  -0.2261000      -4.147400      0.3990000    
 H    1.619700      8.1600003E-02  -1.907000    
 H  -3.0300001E-02 -0.5071000      -2.074600    
 H    3.779600      0.6324000       2.067500    
 H    4.944200      0.6506000      0.7496000    
 H  -0.5584000       4.195300     -0.1394000    
 H  -0.2393000       3.521000       1.460700    
 H    1.806700       4.429600      0.4035000    
 H    1.599500       3.376700     -0.9807000    
 H  -0.4484000       1.868100      -1.120300    
 H  -0.1783000       1.204500      0.4786000    
 H    3.111100       1.416000     -0.8682000    
 H    2.289600       2.463400       1.879900    
 H   -2.577700      -3.511000      0.9348000    
 H   -1.928600      -4.641300       2.133100    
 H   -2.061500      -2.918400       2.526600    
 H    1.016200     -0.1654000      -4.282200    
 H   0.6614000      -1.885100      -4.043700    
 H    2.324100      -1.287900      -3.871100    
 H   -2.367000       2.096800       1.252900    
 H   -2.652300       2.782700     -0.3716000    
 H   -3.880400      -1.607000     -8.6000003E-03
 H   -5.442400     -0.9669000     -0.5632000    
 H   -4.054600     -0.9400000      -1.667900    


%chk=000082528-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000082528

0 1
O -2.515982 0.770080 -0.493580
O -4.670847 1.196247 0.287269
C 1.167096 -1.753073 0.270771
C -0.190891 -2.055061 0.899713
C 1.296819 -2.057513 -1.219219
C 3.574454 -0.846543 0.589121
C 2.171103 -1.217859 1.025074
C -0.464593 -3.571237 1.105887
C 0.767437 -0.905353 -2.121641
C 3.973269 0.605805 1.007948
C 0.014147 3.489634 0.444257
C 1.541571 3.641646 0.190000
C -0.565661 2.192170 -0.164913
C 3.169598 1.673146 0.296015
C 2.367483 2.588055 0.900296
C -1.870570 -3.843115 1.682904
C 0.818258 -1.265269 -3.621665
C -2.057106 2.049944 0.133707
C -3.869165 0.455891 -0.326957
C -4.188101 -0.883127 -0.958167
H -0.998117 -1.634346 0.263131
H -0.269978 -1.548014 1.882112
H 2.347577 -2.268219 -1.495384
H 0.724463 -2.976048 -1.462275
H 4.304673 -1.542360 1.055269
H 3.692743 -0.953205 -0.505437
H 1.957543 -1.018159 2.088689
H 0.307427 -3.984709 1.784048
H -0.353191 -4.107018 0.142314
H 1.371730 0.003047 -1.929080
H -0.270484 -0.652115 -1.830205
H 3.853421 0.716171 2.103864
H 5.052873 0.741077 0.787405
H -0.510490 4.370564 0.021267
H -0.173434 3.505955 1.538043
H 1.851025 4.649797 0.535951
H 1.739514 3.601964 -0.899546
H -0.411670 2.194881 -1.261723
H -0.021276 1.315937 0.232660
H 3.247447 1.681448 -0.804342
H 2.281094 2.571115 1.999631
H -2.658583 -3.471991 0.998760
H -2.042921 -4.923981 1.838533
H -2.007366 -3.334611 2.655970
H 0.452656 -0.431603 -4.249349
H 0.191811 -2.151429 -3.839461
H 1.851309 -1.501448 -3.941270
H -2.264770 1.998303 1.219008
H -2.655740 2.877720 -0.290464
H -3.870609 -1.694831 -0.277379
H -5.272604 -0.966549 -1.122055
H -3.643493 -1.009811 -1.907504


