%chk=000144656.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000144656

0 1
 O    2.069800       2.707800      0.2551000    
 O  -0.7472000       2.746100     -0.4538000    
 O   0.7481000      -2.955400     -0.3911000    
 O   -1.845300      -2.379600      0.5217000    
 O    3.336100      0.1861000      0.5786000    
 O    3.444300      -2.050900     -0.1532000    
 O   -3.448800       1.802700     -0.1925000    
 O   -3.948400     -0.5235000      0.1309000    
 C    1.138300       3.707400      0.6704000    
 C   0.1063000       3.892100     -0.4309000    
 C  -0.3085000      -3.909400     -0.4859000    
 C   -1.266200      -3.676000      0.6717000    
 C    3.061000       2.460800       1.253900    
 C   -1.729500       2.843500      -1.486500    
 C    1.721400      -3.127700      -1.421400    
 C   -2.828100      -2.116000       1.522700    
 C    4.034600       1.421900      0.7202000    
 C    2.680600      -1.950800      -1.356700    
 C   -2.670700       1.653300      -1.381200    
 C   -3.279400     -0.6706000       1.383600    
 C    4.184800     -0.8585000      0.1091000    
 C   -4.453200      0.7967000     -6.4800002E-02
 H    1.674400       4.647900      0.8367000    
 H   0.6539000       3.387500       1.599800    
 H  -0.4974000       4.782400     -0.2243000    
 H   0.5982000       3.995900      -1.404600    
 H   0.1039000      -4.922700     -0.4337000    
 H  -0.8287000      -3.770600      -1.440300    
 H   -2.054200      -4.436700      0.6628000    
 H  -0.7267000      -3.714100       1.624800    
 H    2.568900       2.091200       2.160600    
 H    3.595400       3.390700       1.476100    
 H   -1.226300       2.836200      -2.459300    
 H   -2.289400       3.778300      -1.367900    
 H    1.226700      -3.146100      -2.398600    
 H    2.250300      -4.072400      -1.254700    
 H   -2.395500      -2.273500       2.516700    
 H   -3.673300      -2.797300       1.375500    
 H    4.419500       1.729400     -0.2586000    
 H    4.866100       1.293200       1.421300    
 H    3.364600      -1.973300      -2.211600    
 H   -2.102100      0.7188000      -1.324500    
 H    2.116300      -1.011200      -1.363300    
 H   -3.334100       1.631400      -2.252400    
 H   -3.965900     -0.4167000       2.198400    
 H   -2.412200     -1.6000000E-03   1.409900    
 H    4.726900     -0.5503000     -0.7935000    
 H    4.914000      -1.095300      0.8909000    
 H   -5.100900       1.067300      0.7766000    
 H   -5.081200      0.7923000     -0.9626000    


%chk=000144656-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000144656

0 1
O 2.473755 2.299930 0.154481
O -0.503540 1.898486 -0.574525
O 0.595143 -2.284743 -0.234333
O -2.237037 -2.094680 0.567915
O 4.449176 0.059647 1.128495
O 3.541901 -1.701209 -0.254564
O -3.469169 1.498598 -0.262662
O -4.668258 -0.534512 0.345704
C 1.299522 3.108392 0.505546
C 0.320794 3.104614 -0.660324
C -0.456263 -3.230826 -0.599278
C -1.437084 -3.321057 0.560506
C 3.483279 2.322090 1.220091
C -1.506018 1.831919 -1.644195
C 1.404389 -1.883591 -1.385303
C -3.295646 -2.108734 1.577364
C 4.673688 1.471124 0.788346
C 2.479163 -0.917784 -0.917337
C -2.584913 0.834420 -1.249756
C -3.928158 -0.724603 1.608840
C 4.705685 -0.935736 0.086193
C -4.750951 0.850974 -0.087628
H 1.622793 4.153005 0.719407
H 0.795676 2.699514 1.406587
H -0.332205 4.004918 -0.599900
H 0.886082 3.144470 -1.617875
H -0.018972 -4.234360 -0.805828
H -1.002547 -2.891012 -1.507933
H -2.093973 -4.210608 0.425555
H -0.879522 -3.429173 1.515869
H 3.067067 1.918860 2.167586
H 3.815871 3.371743 1.396783
H -1.020916 1.509667 -2.593574
H -1.971792 2.829013 -1.806492
H 0.757929 -1.371912 -2.135408
H 1.874521 -2.769937 -1.867428
H -2.876285 -2.340998 2.583052
H -4.060042 -2.877292 1.326679
H 4.837253 1.603759 -0.301805
H 5.580022 1.813040 1.328323
H 2.910580 -0.385949 -1.796187
H -2.146588 -0.078641 -0.806037
H 2.057795 -0.165529 -0.228332
H -3.180471 0.550999 -2.145399
H -4.630956 -0.647043 2.465385
H -3.138415 0.044024 1.704673
H 5.127806 -0.420276 -0.811620
H 5.410762 -1.679004 0.494074
H -5.271308 1.488617 0.654656
H -5.318422 0.788083 -1.038288


