%chk=000101637.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000101637

0 1
 O   0.4882000      0.9185000      -2.111300    
 O  -0.7737000      -1.984800      -1.909800    
 O   -4.148500      -1.649000     -0.2494000    
 O    6.215000       1.992000       1.670500    
 O   -5.532700      0.6322000      6.5899998E-02
 O   -5.832800       2.788400      0.8392000    
 C   7.6300003E-02  -1.359200      0.7204000    
 C    1.392400      -1.250700     -6.1299998E-02
 C   -1.075700     -0.5978000      5.2099999E-02
 C    1.794600      0.2687000     -0.1418000    
 C    3.205800      0.4599000     -0.8192000    
 C   0.6381000       1.140200     -0.7142000    
 C  -0.7179000      0.8928000     -1.0400000E-02
 C   -2.237400     -0.9614000      0.9951000    
 C  -0.5170000      -2.736600      0.9977000    
 C    2.491500      -2.106100      0.6019000    
 C   -1.980700      -2.438500       1.365400    
 C    4.173900     -0.3988000      4.8000002E-03
 C    3.878500      -1.877000      2.9000000E-03
 C    3.683500       1.939400     -0.8304000    
 C   -1.395000      -1.088000      -1.349500    
 C    3.243000      2.9000000E-03  -2.299900    
 C   -3.600700     -0.7633000      0.4051000    
 C    4.156700       2.436200      0.5235000    
 C    5.144700      9.0999998E-02  0.7935000    
 C    5.270000       1.549800       1.021300    
 C   -4.253500      0.5784000      0.6611000    
 C   -6.227300       1.803800      0.2292000    
 C   -7.559300       1.716700     -0.4523000    
 H   0.2588000     -0.9061000       1.709600    
 H    1.277500      -1.638500      -1.074100    
 H    1.904400      0.6017000      0.9030000    
 H   0.8838000       2.199400     -0.5840000    
 H  -0.6636000       1.303300       1.005800    
 H   -1.499400       1.446200     -0.5438000    
 H   -2.176700     -0.3735000       1.921100    
 H  -1.1000000E-03  -3.245900       1.818300    
 H  -0.4658000      -3.394300      0.1240000    
 H    2.240100      -3.169800      0.5132000    
 H    2.528400      -1.882900       1.676800    
 H   -2.640600      -3.151900      0.8615000    
 H   -2.134400      -2.578000       2.442300    
 H    3.933400      -2.281500      -1.013300    
 H    4.616400      -2.435700      0.5916000    
 H    2.908100       2.606200      -1.220700    
 H    4.528700       2.038000      -1.528500    
 H   -2.214500     -0.5679000      -1.875300    
 H    2.766800      0.7351000      -2.960500    
 H    4.278200     -0.1012000      -2.649400    
 H    2.752200     -0.9583000      -2.471500    
 H    3.350400       2.448700       1.263100    
 H    4.543500       3.456000      0.4201000    
 H    5.799200     -0.5534000       1.370200    
 H  -0.2014000       1.522900      -2.434600    
 H   -3.622400       1.363900      0.2378000    
 H   -4.348300      0.7092000       1.744600    
 H   -8.147200      0.9069000     -1.3100000E-02
 H   -7.416700       1.552400      -1.523200    
 H   -8.100900       2.656600     -0.3124000    


%chk=000101637-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000101637

0 1
O 0.694774 0.542283 -2.389055
O -1.277308 -2.057305 -1.518487
O -3.695624 0.922025 -0.641447
O 6.473241 2.083592 1.310296
O -5.896433 0.963449 1.015721
O -6.591394 -0.816728 -0.326037
C 0.046449 -0.904602 0.856244
C 1.378987 -1.124017 0.109730
C -0.993820 -0.113717 0.009707
C 1.952831 0.276983 -0.295816
C 3.382535 0.153212 -0.979934
C 0.923376 1.152765 -1.056738
C -0.432835 1.284197 -0.314349
C -2.214966 -0.158461 0.991199
C -0.735150 -2.126185 1.415989
C 2.377388 -1.897784 1.008709
C -2.226824 -1.648300 1.502024
C 4.249205 -0.550573 0.077623
C 3.821329 -1.959322 0.424190
C 4.007312 1.531771 -1.350892
C -1.397363 -0.827032 -1.302389
C 3.365550 -0.697954 -2.288534
C -3.551121 0.360137 0.473841
C 4.519198 2.349690 -0.148015
C 5.247349 0.086366 0.772163
C 5.516163 1.535982 0.680788
C -4.741209 0.162814 1.427387
C -6.734666 0.365807 0.046392
C -7.770922 1.355456 -0.423612
H 0.281037 -0.243680 1.724630
H 1.175095 -1.714515 -0.802098
H 2.122937 0.827251 0.658730
H 1.344775 2.170868 -1.194409
H -0.281749 1.853593 0.625312
H -1.141458 1.867947 -0.935150
H -1.950555 0.488821 1.859983
H -0.349368 -2.435655 2.403343
H -0.655390 -2.981747 0.726612
H 2.004925 -2.925774 1.176615
H 2.426198 -1.401913 2.001346
H -2.860491 -2.269092 0.844298
H -2.633569 -1.718807 2.526223
H 3.822663 -2.608992 -0.471128
H 4.507314 -2.408493 1.164797
H 3.290624 2.122895 -1.949455
H 4.868203 1.333029 -2.019885
H -1.893828 -0.163701 -2.048208
H 2.901789 -0.120029 -3.102822
H 4.402149 -0.956970 -2.575874
H 2.791265 -1.633136 -2.195028
H 3.683829 2.642349 0.522155
H 5.008851 3.285499 -0.470524
H 5.858847 -0.465268 1.498354
H 0.058327 1.109481 -2.895748
H -4.488056 0.492393 2.449173
H -5.006596 -0.913418 1.441702
H -7.305731 2.037612 -1.158017
H -8.138197 1.967816 0.415314
H -8.602991 0.824382 -0.908236


