%chk=000128555.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000128555

0 1
 O    3.246200      0.1833000     -0.4888000    
 O   -4.382700     -1.5699999E-02  -1.308400    
 O   -2.119100     -0.3234000      -1.594400    
 C    1.821700       2.603100     -4.8700001E-02
 C    2.158100      -2.408100     -6.0100000E-02
 C    1.203700       1.216200      0.1939000    
 C    1.383800      -1.154500      0.1826000    
 C    1.960200      9.5399998E-02 -4.3699998E-02
 C  -9.3300000E-02   1.166700      0.6442000    
 C   6.8999998E-02  -1.243700      0.6398000    
 C  -0.6695000     -8.3099999E-02  0.8705000    
 C    3.078600       2.885600      0.8052000    
 C    2.238000       2.734800      -1.529800    
 C   0.7869000       3.698900      0.2871000    
 C    1.217800      -3.579200     -0.4803000    
 C    2.924200      -2.855200       1.222700    
 C    3.242000      -2.318600      -1.184100    
 C   -2.040500     -0.1760000       1.347600    
 C   -3.138500     -0.2279000      0.5920000    
 C   -4.551200     -0.2826000       1.028400    
 C   -5.237000      0.2801000     -0.1934000    
 C   -3.098300     -0.1962000     -0.8823000    
 H  -0.7218000       2.024200      0.8457000    
 H  -0.4073000      -2.194700      0.8541000    
 H    3.419800       3.919600      0.6754000    
 H    2.864100       2.738000       1.870200    
 H    3.926200       2.242600      0.5530000    
 H    1.408200       2.471600      -2.196900    
 H    2.521800       3.769300      -1.759400    
 H    3.094500       2.114900      -1.807400    
 H    1.221000       4.691000      0.1035000    
 H  -0.1032000       3.651600     -0.3520000    
 H   0.4939000       3.697100       1.344000    
 H    1.796000      -4.459300     -0.7879000    
 H   0.5817000      -3.926400      0.3410000    
 H   0.5798000      -3.297400      -1.326400    
 H    2.229800      -3.028200       2.053300    
 H    3.479300      -3.784600       1.051500    
 H    3.637400      -2.089700       1.548500    
 H    3.544800      -3.322800      -1.508800    
 H    2.859600      -1.806200      -2.074400    
 H    4.176400      -1.851600     -0.8596000    
 H   -2.144700     -0.1908000       2.430200    
 H    3.810700     -0.1370000      0.2368000    
 H   -4.848500      -1.324300       1.191000    
 H   -4.770500      0.2982000       1.928100    
 H   -6.217200     -0.1782000     -0.3556000    
 H   -5.365000       1.367000     -0.1355000    


%chk=000128555-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000128555

0 1
O 3.442313 0.288600 -0.137426
O -4.736020 -2.216725 0.000878
O -2.478569 -2.708737 0.003757
C 2.219702 2.847147 0.336102
C 2.005246 -2.335369 -0.350623
C 1.411243 1.527091 0.233693
C 1.306407 -0.967391 -0.099927
C 2.040848 0.262303 -0.004231
C 0.010591 1.513420 0.372386
C -0.093354 -0.904151 0.048241
C -0.771303 0.323527 0.284625
C 3.228675 2.766346 1.522886
C 2.984731 3.112180 -0.997114
C 1.299902 4.071770 0.594095
C 0.976236 -3.498892 -0.411833
C 2.983720 -2.682572 0.819405
C 2.748145 -2.339553 -1.727798
C -2.216973 0.475036 0.456368
C -3.302283 -0.375443 0.400730
C -4.729710 0.105212 0.659781
C -5.597450 -0.999546 0.014611
C -3.367842 -1.835568 0.121465
H -0.510468 2.458130 0.554367
H -0.689852 -1.814795 -0.008855
H 3.795314 3.714198 1.594648
H 2.694588 2.613164 2.479256
H 3.944954 1.941865 1.385496
H 2.276225 3.204624 -1.841406
H 3.551212 4.059622 -0.919139
H 3.692914 2.299770 -1.220530
H 1.925715 4.980574 0.656832
H 0.571143 4.225794 -0.223799
H 0.747418 3.983039 1.548250
H 1.516660 -4.446894 -0.589892
H 0.410863 -3.603616 0.530150
H 0.244994 -3.366972 -1.228136
H 2.423231 -2.752096 1.768785
H 3.460984 -3.661477 0.628565
H 3.794844 -1.947937 0.984937
H 3.204173 -3.331585 -1.901172
H 2.030316 -2.142265 -2.543869
H 3.555045 -1.588265 -1.827517
H -2.498175 1.518695 0.676757
H 3.791028 -0.619024 -0.308678
H -4.925654 0.160716 1.748348
H -4.936902 1.099352 0.228454
H -6.505142 -1.253015 0.583023
H -5.862786 -0.766485 -1.032544


