%chk=000124072.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000124072

0 1
 O    1.457700      -3.276500       1.087100    
 O    4.013200      -1.889000       1.084700    
 O   -4.238800       1.550700      0.6249000    
 O   0.4450000       1.825200       1.692100    
 O   -5.909800      0.2105000      -1.146900    
 O  -0.4282000       3.139000     -0.5966000    
 C   0.1005000      -1.862300     -0.3247000    
 C    4.640000     -0.7865000     -0.9656000    
 C   -1.085100      -2.195500      0.5811000    
 C    4.667600      0.6722000     -0.5051000    
 C    2.593000      -2.340400     -0.7968000    
 C    1.388900      -2.555700      9.2100002E-02
 C    3.758200      -1.672300     -9.9600002E-02
 C   -2.370900      -1.551100      0.1226000    
 C    3.307800       1.328700     -0.5261000    
 C   -2.720500     -0.2835000      0.5878000    
 C    2.490200       1.276200      0.6027000    
 C   -3.209400      -2.223500     -0.7664000    
 C    2.869500       1.988100      -1.674600    
 C   -3.908500      0.3121000      0.1638000    
 C    1.234400       1.883200      0.5833000    
 C   -4.397600      -1.628200      -1.190200    
 C    1.613600       2.594700      -1.694100    
 C   -4.747100     -0.3603000     -0.7253000    
 C   0.7960000       2.542400     -0.5651000    
 C   -3.327300       2.169400       1.530600    
 C   0.9675000       1.132400       2.824100    
 H   0.2803000     -0.7832000     -0.3286000    
 H  -0.1227000      -2.171200      -1.352900    
 H    5.651600      -1.208000     -0.9399000    
 H    4.306100     -0.8459000      -2.007700    
 H   -1.224600      -3.283500      0.6319000    
 H  -0.8668000      -1.886000       1.611800    
 H    5.357700       1.240800      -1.141100    
 H    5.081200      0.7340000      0.5099000    
 H    2.281300      -1.718100      -1.642400    
 H    2.918600      -3.305100      -1.197300    
 H   -2.028600      0.1903000       1.275800    
 H    2.884200      0.7555000       1.468700    
 H   -2.946700      -3.210700      -1.137200    
 H    3.496700       2.033600      -2.560900    
 H   -5.041300      -2.163000      -1.883400    
 H    1.284200       3.104300      -2.595700    
 H   -6.358700     -0.3990000      -1.757600    
 H  -0.5621000       3.541700      -1.471700    
 H   -3.746400       3.146700       1.791900    
 H   -2.357100       2.355700       1.062800    
 H   -3.238000       1.602700       2.463700    
 H   0.2071000       1.182800       3.610500    
 H    1.865200       1.620700       3.218100    
 H    1.129000      7.0600003E-02   2.607700    


%chk=000124072-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000124072

0 1
O 1.269447 -3.927066 1.654812
O 4.006531 -1.076623 0.984313
O -3.527103 1.709633 0.430839
O 1.008094 2.693918 2.320440
O -4.260699 1.373376 -2.135490
O -1.107358 3.085260 0.717549
C 0.485989 -2.330563 -0.020999
C 3.476939 -1.040821 -1.404760
C -0.972337 -2.632251 0.406431
C 3.600988 0.505422 -1.413887
C 2.987328 -3.110890 0.128002
C 1.537853 -3.184835 0.677985
C 3.523929 -1.675810 -0.012273
C -1.930449 -1.648475 -0.249127
C 2.356238 1.206720 -0.881236
C -2.346319 -0.484757 0.445648
C 2.302121 1.640424 0.469757
C -2.345356 -1.816797 -1.591099
C 1.225849 1.414094 -1.705698
C -3.126138 0.506168 -0.186693
C 1.146451 2.262452 0.993879
C -3.129744 -0.832407 -2.232841
C 0.064300 2.036443 -1.192005
C -3.512481 0.340224 -1.546317
C 0.007694 2.460313 0.153297
C -3.596770 1.710932 1.908972
C 2.167102 2.516166 3.199621
H 0.726622 -1.264023 0.181214
H 0.597271 -2.442600 -1.118472
H 4.318371 -1.493217 -1.976179
H 2.555212 -1.363793 -1.926146
H -1.219301 -3.673939 0.128402
H -1.036819 -2.579365 1.507565
H 3.796982 0.825859 -2.454771
H 4.483152 0.785645 -0.810913
H 2.995693 -3.610410 -0.860736
H 3.627592 -3.672658 0.828090
H -2.026142 -0.338410 1.482701
H 3.170733 1.459040 1.109520
H -2.054683 -2.718446 -2.142875
H 1.249851 1.101656 -2.756765
H -3.447667 -0.975624 -3.274266
H -0.808064 2.199002 -1.836905
H -4.492143 1.137274 -3.068416
H -1.949744 2.874921 0.222424
H -4.148372 2.628185 2.161934
H -2.585053 1.757214 2.349954
H -4.146668 0.821367 2.265682
H 1.848602 2.915123 4.173942
H 3.042617 3.085084 2.830475
H 2.439960 1.447570 3.301620


