%chk=000126781.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126781

0 1
 O   -2.387200      -2.721300      0.7922000    
 O   0.9046000       1.455100      0.1617000    
 O    5.384800      2.8200001E-02   1.231500    
 O    5.475500      -1.418900     -0.6936000    
 C   -2.356500      -2.460300     -0.6124000    
 C   -3.319300      -1.300000     -0.9421000    
 C   -3.006200      2.4700001E-02 -0.2329000    
 C   -3.969000       1.131500     -0.6859000    
 C   -3.682500       2.492000     -2.1000000E-02
 C  -0.9218000      -2.041700     -0.9499000    
 C   -2.703300      -3.750200      -1.359700    
 C   -4.691200       3.536800     -0.5052000    
 C   -2.283000       2.975600     -0.3145000    
 C   -3.681700      -3.120000       1.212900    
 C   -1.366000       3.221600      0.6334000    
 C   3.0400001E-02   3.695100      0.3424000    
 C   -3.656800      -3.382600       2.703600    
 C    1.077700       2.699400      0.8271000    
 C    2.036400      0.7215000     -8.1000000E-02
 C    4.235400      6.3199997E-02  0.5038000    
 C    3.119000      0.8218000      0.7898000    
 C    4.287200     -0.7630000     -0.5957000    
 C    2.082600     -0.1183000      -1.202800    
 C    3.225300     -0.8762000      -1.469500    
 C    6.165700     -0.9137000      0.4677000    
 H   -4.367000      -1.569600     -0.7736000    
 H   -3.259200      -1.119600      -2.025400    
 H   -1.982200      0.3314000     -0.4617000    
 H   -3.078400     -0.1020000      0.8531000    
 H   -4.997700      0.8277000     -0.4528000    
 H   -3.911600       1.234800      -1.777700    
 H   -3.815300       2.375900       1.062800    
 H  -0.2396000      -2.893200     -0.8362000    
 H  -0.5498000      -1.281300     -0.2568000    
 H  -0.8344000      -1.675200      -1.977500    
 H   -2.421800      -3.673100      -2.416300    
 H   -3.776900      -3.965600      -1.346800    
 H   -2.184800      -4.614500     -0.9298000    
 H   -5.714400       3.224200     -0.2701000    
 H   -4.626500       3.688300      -1.588800    
 H   -4.519400       4.503700     -1.8999999E-02
 H   -2.019700       3.119600      -1.360100    
 H   -4.430400      -2.341300       1.053300    
 H   -4.004500      -4.046400      0.7312000    
 H   -1.626600       3.080500       1.679400    
 H   0.1566000       3.854300     -0.7355000    
 H   0.1849000       4.661100      0.8362000    
 H   -3.348700      -2.483800       3.248400    
 H   -2.930000      -4.165400       2.945200    
 H   -4.641400      -3.693000       3.064900    
 H    2.056800       3.147000      0.6121000    
 H   0.9867000       2.543000       1.908800    
 H    3.111700       1.436800       1.682100    
 H    1.233500     -0.1741000      -1.878100    
 H    3.270900      -1.526100      -2.335900    
 H    6.428200      -1.758400       1.115000    
 H    7.088400     -0.4208000      0.1407000    


%chk=000126781-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000126781

0 1
O -2.630912 -2.805212 1.123388
O 1.078252 2.190749 -0.541288
O 5.146808 -0.369129 0.825560
O 5.006838 -1.763474 -1.120718
C -1.948675 -2.479341 -0.170246
C -2.651142 -1.289731 -0.885564
C -2.727230 0.012692 -0.059312
C -3.678969 1.055397 -0.684935
C -3.663482 2.434340 0.044487
C -0.521007 -2.121759 0.285866
C -1.920982 -3.721445 -1.093269
C -4.845867 3.318515 -0.429388
C -2.342754 3.147221 -0.182393
C -4.040560 -3.210908 1.056238
C -1.391514 3.377022 0.757622
C -0.063763 4.058984 0.496010
C -4.466386 -3.546214 2.488159
C 1.141137 3.109261 0.608372
C 2.072919 1.206072 -0.653557
C 4.012468 -0.015516 0.048739
C 3.111525 1.021509 0.307172
C 3.923850 -0.836668 -1.091052
C 1.978759 0.382677 -1.805390
C 2.914942 -0.655609 -2.041599
C 5.634887 -1.638831 0.216952
H -3.676265 -1.601451 -1.176324
H -2.111993 -1.095576 -1.835313
H -1.718346 0.456901 0.035149
H -3.065104 -0.232104 0.967858
H -4.717071 0.661208 -0.675474
H -3.414951 1.212741 -1.752727
H -3.778382 2.244456 1.132364
H -0.026342 -3.013772 0.708622
H -0.551260 -1.347304 1.069956
H 0.084223 -1.744145 -0.557552
H -1.245901 -3.541951 -1.950067
H -2.920094 -3.962556 -1.500411
H -1.546445 -4.598408 -0.535612
H -5.813966 2.818741 -0.237598
H -4.777533 3.515361 -1.516872
H -4.850252 4.293399 0.090800
H -2.154485 3.477507 -1.218117
H -4.667784 -2.388804 0.647823
H -4.166121 -4.097280 0.398343
H -1.567704 3.033784 1.790231
H -0.055895 4.514926 -0.511261
H 0.095619 4.876958 1.228812
H -4.337284 -2.667345 3.143710
H -3.847076 -4.366711 2.890139
H -5.527409 -3.856327 2.517680
H 2.094571 3.676974 0.572729
H 1.102778 2.531198 1.555497
H 3.214802 1.641625 1.199506
H 1.164451 0.572323 -2.509970
H 2.851663 -1.284490 -2.933095
H 5.310753 -2.485117 0.853712
H 6.727162 -1.580162 0.098607


