%chk=000107974.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000107974

0 1
 O    2.801600      0.5696000      -1.575700    
 O   5.7599999E-02  -1.682500     -0.7815000    
 O    3.488900      7.2200000E-02   1.425600    
 O   -3.481800       1.746000     -0.3754000    
 C    1.288700      0.6105000      0.4225000    
 C    1.576900      0.1144000     -0.9803000    
 C  -0.2738000      0.3464000      0.6686000    
 C    1.449400      -1.365600     -0.8989000    
 C    2.161300     -0.4181000       1.241700    
 C    1.588500      0.9103000      -2.262200    
 C    2.228700      -1.706700      0.3816000    
 C  -0.5992000      -1.160600      0.3885000    
 C    1.710200       2.063600      0.6734000    
 C   -1.149600       1.220500     -0.2683000    
 C  -0.6679000      0.6966000       2.130600    
 C   -2.063200      -1.453200      0.2120000    
 C   -2.625700      0.8771000     -0.2119000    
 C   -3.020200     -0.5479000     -3.3300001E-02
 C   -4.470400     -0.8927000     -0.1569000    
 H    1.848200      -1.893700      -1.770300    
 H    1.768900     -0.6270000       2.238200    
 H    1.375000      0.3930000      -3.188800    
 H    1.282000       1.947400      -2.243700    
 H    1.795700      -2.564200      0.9061000    
 H    3.269400      -1.950800      0.1376000    
 H  -0.2752000      -1.761000       1.248100    
 H    2.751900       2.247700      0.3889000    
 H    1.111200       2.769600      9.0999998E-02
 H    1.614500       2.328400       1.730900    
 H  -0.8622000       1.115200      -1.318000    
 H   -1.053300       2.278700      3.0000001E-04
 H  -9.7499996E-02  0.1186000       2.862100    
 H  -0.5064000       1.758100       2.344800    
 H   -1.724200      0.4922000       2.334400    
 H   -2.347400      -2.498900      0.3127000    
 H    3.884200      0.2149000      0.5486000    
 H   -4.648600      -1.965600     -2.9700000E-02
 H   -4.848700     -0.6083000      -1.144300    
 H   -5.054600     -0.3664000      0.6050000    


%chk=000107974-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000107974

0 1
O 2.989219 0.566646 -1.533398
O -0.014257 -1.676466 -0.864760
O 3.497313 0.074130 1.499051
O -3.520647 1.764273 -0.422095
C 1.269188 0.602594 0.416359
C 1.617263 0.138893 -1.010038
C -0.290892 0.341772 0.649492
C 1.435312 -1.374736 -0.962067
C 2.154190 -0.447304 1.224113
C 1.707249 0.961586 -2.241368
C 2.210384 -1.734444 0.328567
C -0.610513 -1.168924 0.408357
C 1.669886 2.056739 0.732054
C -1.155555 1.159632 -0.354886
C -0.685758 0.725982 2.100317
C -2.085854 -1.482630 0.294630
C -2.650626 0.861086 -0.245376
C -3.051966 -0.560397 0.004731
C -4.524690 -0.887478 -0.078024
H 1.773145 -1.902821 -1.866378
H 1.748047 -0.650713 2.226923
H 1.569100 0.486939 -3.220780
H 1.479502 2.033748 -2.193830
H 1.789635 -2.628009 0.820726
H 3.264910 -1.953893 0.088791
H -0.188767 -1.761096 1.249535
H 2.633699 2.305024 0.256395
H 0.919304 2.779318 0.367050
H 1.795248 2.201684 1.817206
H -0.862518 0.896246 -1.391035
H -1.020756 2.247740 -0.232816
H -0.070825 0.199135 2.851151
H -0.559793 1.809594 2.265243
H -1.742298 0.479928 2.304552
H -2.364416 -2.534473 0.440454
H 3.897476 0.365949 0.637272
H -4.714181 -1.955135 0.123945
H -4.923073 -0.635375 -1.077513
H -5.099781 -0.276943 0.641450


