%chk=000099801.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099801

0 1
 O   -1.873200      0.8564000       1.496700    
 O   -2.395800     -0.4682000     -0.3847000    
 O   0.9280000       2.258200     -0.7277000    
 O    2.741900      -1.111600      0.1601000    
 O   -1.193100       1.822700      -1.516900    
 O    1.158800      -2.719500      0.6296000    
 O  -0.4894000      -2.877100      -1.649000    
 C  -8.0399998E-02  0.2372000     -2.5400000E-02
 C   0.6279000     -0.8606000     -0.8553000    
 C   -1.420600     -0.1908000      0.6265000    
 C  -0.2140000       1.516700     -0.8494000    
 C    1.510300      -1.695700      5.8800001E-02
 C  -0.3328000      -1.662400      -1.714900    
 C   -1.207200      0.8612000       2.752400    
 C   -3.446900      -1.300700      8.6400002E-02
 C   0.9445000       3.489800      -1.456000    
 C   -1.751000       1.995500       3.594600    
 C   -4.427900      -1.542200      -1.041000    
 C    3.674300      -1.781200       1.014700    
 C    2.267400       4.186000      -1.217600    
 C    4.979200      -1.013800       1.018000    
 H   0.5983000      0.5102000      0.7922000    
 H    1.302300     -0.3955000      -1.589400    
 H   -1.248700      -1.104900       1.211000    
 H  -0.8880000      -1.074700      -2.467500    
 H   -1.384400     -9.0599999E-02   3.265300    
 H  -0.1300000       1.002100       2.634100    
 H   -3.037700      -2.259000      0.4252000    
 H   -3.957100     -0.8148000      0.9253000    
 H   0.8222000       3.283300      -2.525000    
 H   0.1230000       4.128200      -1.112200    
 H   -1.591600       2.956800       3.094900    
 H   -2.831200       1.886300       3.737500    
 H   -1.266600       2.022600       4.574800    
 H   -4.839100     -0.5943000      -1.403500    
 H   -3.927800      -2.017800      -1.891200    
 H   -5.251600      -2.182000     -0.7125000    
 H    3.843900      -2.798300      0.6442000    
 H    3.269200      -1.826900       2.031700    
 H    2.412200       4.383100     -0.1503000    
 H    3.099900       3.551700      -1.539300    
 H    2.314500       5.133600      -1.761400    
 H    5.387700     -0.9439000      4.4999998E-03
 H    4.822000      1.1600000E-02   1.368700    
 H    5.716700      -1.498800       1.663600    


%chk=000099801-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099801

0 1
O -1.580279 1.308362 1.291051
O -1.645084 -0.357711 -0.342433
O 0.259735 2.940517 -0.426055
O 2.979579 -2.183291 0.042220
O 0.263679 1.492384 -2.250030
O 1.573949 -1.504576 1.768966
O 0.201313 -2.755594 -1.262881
C 0.516670 0.609155 0.054079
C 1.257985 -0.630917 -0.530697
C -0.840545 0.194592 0.708637
C 0.326373 1.682465 -1.012291
C 1.922770 -1.457703 0.563268
C 0.341926 -1.521269 -1.422802
C -1.020185 1.801498 2.565498
C -2.794565 -1.170338 0.129187
C -0.042495 4.081798 -1.347277
C -2.053315 2.747781 3.175719
C -3.454292 -1.780293 -1.105186
C 3.637204 -3.160828 0.968647
C -0.139665 5.331710 -0.479677
C 4.694306 -3.894641 0.151778
H 1.132693 1.046215 0.860370
H 2.047827 -0.274667 -1.222170
H -0.625305 -0.559390 1.500596
H -0.108458 -0.964011 -2.269155
H -0.809665 0.942408 3.239167
H -0.068884 2.336907 2.367973
H -2.413861 -1.956271 0.815266
H -3.483195 -0.506534 0.684889
H 0.766947 4.144365 -2.097115
H -0.986445 3.854115 -1.873523
H -2.266075 3.579301 2.481509
H -2.998980 2.216165 3.378532
H -1.675487 3.170307 4.124699
H -3.792713 -0.987136 -1.793826
H -2.745498 -2.435059 -1.639815
H -4.331718 -2.382666 -0.806597
H 2.854602 -3.835425 1.358647
H 4.066586 -2.596327 1.816143
H -0.941356 5.224981 0.271168
H 0.810636 5.523180 0.047677
H -0.369029 6.208844 -1.111847
H 4.232570 -4.425166 -0.697837
H 5.448693 -3.192578 -0.242760
H 5.209148 -4.636757 0.788888


