%chk=000099904.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099904

0 1
 O   -1.620500       1.741600       1.379700    
 O   -1.463900     -0.8558000     -0.1386000    
 O    3.731700     -0.1342000     -0.3830000    
 O   -3.762200       2.348500      0.7799000    
 O    2.902000      0.7017000      -2.359000    
 O   -2.059600      -2.562300      -1.563800    
 C  -0.6524000       1.402200     -0.7653000    
 C  -0.8599000     -8.9000002E-02  -1.178300    
 C  -0.3526000       1.791900      0.6986000    
 C   0.3520000     -0.8414000      -1.794200    
 C   -1.983800       2.097800     -0.8415000    
 C    1.620400     -0.8202000      -1.020600    
 C   0.6473000      0.9436000       1.416700    
 C    3.179400     -0.9059000      0.6937000    
 C    2.894100      1.8400000E-02   1.909900    
 C    1.968400       1.182000       1.553900    
 C    1.942900      -1.468000      9.8800004E-02
 C   -2.603300       2.102200      0.5016000    
 C    2.787700      7.3000002E-03  -1.363800    
 C   -2.556800       2.685400      -1.894200    
 C    2.659400       2.476200       1.222300    
 C   -1.765000      -2.146900     -0.4519000    
 C   -1.684300      -2.992200      0.7717000    
 C   -1.982000      -2.405100       2.117400    
 C   -1.338900      -4.277900      0.6098000    
 H   7.0900001E-02   1.872500      -1.442200    
 H   -1.596000     -7.3799998E-02  -1.997500    
 H  -4.4000000E-02   2.843800      0.7431000    
 H   0.5488000     -0.3739000      -2.768900    
 H   0.1329000      -1.885100      -2.035800    
 H   0.2761000     -3.2200001E-02   1.720600    
 H    3.888900      -1.696200      0.9576000    
 H    3.843100      0.4225000       2.283800    
 H    2.458700     -0.5684000       2.728900    
 H    1.296400      -2.163000      0.6145000    
 H   -2.066800       2.683700      -2.862100    
 H   -3.519900       3.178500      -1.819500    
 H    1.976400       3.271300      0.9179000    
 H    3.382500       2.341200      0.4133000    
 H    3.199800       2.839400       2.103100    
 H   -1.190000      -1.716300       2.423400    
 H   -2.930400      -1.858400       2.093600    
 H   -2.067900      -3.177400       2.889400    
 H   -1.261000      -4.946800       1.461000    
 H   -1.118400      -4.698800     -0.3657000    


%chk=000099904-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000099904

0 1
O -1.457281 1.588157 1.429315
O -1.017129 -1.079282 -0.132424
O 3.923486 0.485484 -0.428209
O -3.734577 1.859889 1.018272
O 2.769286 1.434298 -2.234019
O -1.953679 -2.644557 -1.590231
C -0.644657 1.239864 -0.861642
C -0.599009 -0.257198 -1.305479
C -0.188047 1.637389 0.601257
C 0.713272 -0.807629 -1.944531
C -2.093431 1.719035 -0.841680
C 1.967751 -0.641493 -1.138253
C 0.861311 0.800687 1.255923
C 3.604982 -0.595665 0.552208
C 3.150426 0.098703 1.899043
C 2.125400 1.191569 1.594967
C 2.474074 -1.359324 -0.096880
C -2.575307 1.743201 0.580185
C 2.861436 0.535209 -1.376137
C -2.890265 2.063930 -1.881452
C 2.661911 2.607621 1.546822
C -1.747145 -2.253136 -0.415188
C -2.213645 -2.910514 0.848237
C -1.920566 -2.246177 2.177429
C -2.902863 -4.078387 0.715289
H -0.031654 1.803450 -1.588317
H -1.377471 -0.399196 -2.080569
H 0.103795 2.702723 0.568753
H 0.839483 -0.274248 -2.906510
H 0.521035 -1.869227 -2.179919
H 0.573074 -0.247760 1.379694
H 4.529361 -1.176917 0.708471
H 4.050004 0.518545 2.382507
H 2.741243 -0.685062 2.563822
H 2.058815 -2.273131 0.332859
H -2.538395 2.054543 -2.919288
H -3.926265 2.369596 -1.695797
H 1.882647 3.360942 1.347246
H 3.446457 2.704921 0.773428
H 3.130844 2.862635 2.516760
H -0.832082 -2.169489 2.357194
H -2.313063 -1.214379 2.206350
H -2.369746 -2.819644 3.005335
H -3.290032 -4.612882 1.589140
H -3.093581 -4.504596 -0.275682


