%chk=000077586.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000077586

0 1
 O   -3.688000     -0.2708000     -0.5495000    
 O    3.710200      -2.037700      0.4097000    
 O    4.894500      8.0499999E-02 -0.9461000    
 O   -3.163000      0.6273000       1.509500    
 C  -0.4003000      0.5383000      0.9520000    
 C    1.013600      0.4127000      0.4468000    
 C   -1.416600      6.9499999E-02 -8.8799998E-02
 C    1.713800     -0.7650000      0.6643000    
 C    1.593400       1.476800     -0.2283000    
 C   -2.836900      0.1887000      0.4151000    
 C    3.022700     -0.8812000      0.1963000    
 C    2.902500       1.360700     -0.6961000    
 C    3.617000      0.1817000     -0.4840000    
 C   -5.079600     -0.2208000     -0.2184000    
 C   -5.883200     -0.7608000      -1.382200    
 H  -0.6001000       1.580500       1.234300    
 H  -0.5136000     -3.8899999E-02   1.879300    
 H   -1.326900      0.6724000      -1.000100    
 H   -1.232800     -0.9807000     -0.3447000    
 H    1.253100      -1.595800       1.192400    
 H    1.044500       2.398300     -0.4003000    
 H    3.353100       2.196300      -1.224900    
 H   -5.264800     -0.8296000      0.6735000    
 H   -5.370000      0.8165000     -1.7700000E-02
 H   -6.954100     -0.7370000      -1.162500    
 H   -5.694500     -0.1729000      -2.286500    
 H   -5.590900      -1.791900      -1.606800    
 H    4.596700      -1.942800      1.9900000E-02
 H    5.137400      0.9111000      -1.390200    


%chk=000077586-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000077586

0 1
O -3.738886 -0.311364 -0.547851
O 3.635397 -2.137887 0.182381
O 4.984068 -0.082953 -0.928571
O -3.261968 0.772155 1.459931
C -0.412820 0.655487 0.963291
C 1.021685 0.509707 0.475240
C -1.427012 0.117356 -0.075799
C 1.680329 -0.744867 0.563108
C 1.710573 1.605736 -0.100915
C -2.868147 0.246271 0.392691
C 2.993106 -0.899147 0.084923
C 3.033423 1.460229 -0.586287
C 3.668057 0.209897 -0.492442
C -5.197519 -0.250921 -0.213162
C -5.939685 -0.919588 -1.365576
H -0.644504 1.714939 1.173705
H -0.558499 0.111219 1.914511
H -1.322890 0.656159 -1.037233
H -1.227343 -0.945655 -0.308504
H 1.186042 -1.612908 1.012890
H 1.217203 2.581838 -0.167336
H 3.558689 2.317541 -1.026399
H -5.353427 -0.768093 0.750914
H -5.480190 0.809617 -0.083532
H -7.027613 -0.903389 -1.170433
H -5.749007 -0.392296 -2.315992
H -5.622709 -1.970108 -1.481707
H 4.550835 -2.052768 -0.194123
H 5.430009 0.709192 -1.311725


