%chk=000133840.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000133840

0 1
 O    5.999000       1.962400     -3.4899998E-02
 O    4.697400      -3.079100     -0.5370000    
 O    2.100000      -3.894600     -0.9938000    
 O   -3.120900       1.268300      -1.734500    
 O   -5.160600       1.966500      -1.006300    
 C    3.701000       2.701500      9.9699996E-02
 C    2.251300       2.391500      0.4982000    
 C    4.682300       1.538800      0.3111000    
 C    1.304700       3.579100      0.2888000    
 C    3.675000      -2.094800     -0.7208000    
 C    2.342800      -2.699400     -0.2416000    
 C  -0.1361000       3.286100      0.7089000    
 C    4.323500      0.3194000     -0.4905000    
 C    4.067500     -0.8749000      6.3800000E-02
 C    1.145300      -1.761600     -0.4638000    
 C   -1.052700       4.463600      0.4159000    
 C  -5.2800000E-02  -2.192800      0.3381000    
 C  -0.7442000      -1.467700       1.231800    
 C   -1.939700      -1.893200       2.034000    
 C   -5.493600     -0.7509000      0.8754000    
 C   -5.904100     -0.8447000     -0.5998000    
 C   -3.148400      -1.064200       1.710400    
 C   -4.285500      -1.573500       1.213700    
 C   -4.835300     -0.3597000      -1.580100    
 C   -4.415800       1.074000      -1.386800    
 H    3.732500       3.017400     -0.9518000    
 H    4.058000       3.568600      0.6710000    
 H    1.878000       1.548100     -9.1799997E-02
 H    2.223600       2.086200       1.551200    
 H    4.702200       1.301600       1.382000    
 H    1.677200       4.441200      0.8559000    
 H    1.323200       3.864900     -0.7703000    
 H    3.624200      -1.889900      -1.796900    
 H    2.425000      -3.000800      0.8101000    
 H  -0.5056000       2.402700      0.1750000    
 H  -0.1704000       3.055100       1.779700    
 H    4.263400      0.4338000      -1.570000    
 H    4.134400     -0.9861000       1.143700    
 H    1.398800     -0.7363000     -0.1800000    
 H   0.8608000      -1.748300      -1.522900    
 H   -1.065400       4.694300     -0.6541000    
 H   -2.076800       4.231800      0.7248000    
 H  -0.7280000       5.357800      0.9572000    
 H  -0.3988000      -3.207200      0.1446000    
 H    6.604100       1.220800      0.1381000    
 H    5.526800      -2.711700     -0.8882000    
 H    2.069100      -3.655500      -1.936000    
 H  -0.3997000     -0.4511000       1.420800    
 H   -1.707400      -1.774700       3.098800    
 H   -2.142000      -2.959400       1.875500    
 H   -6.328300      -1.110600       1.489800    
 H   -5.342100      0.2980000       1.156000    
 H   -6.160700      -1.883300     -0.8432000    
 H   -6.818300     -0.2548000     -0.7409000    
 H   -3.080200      5.1000002E-03   1.897400    
 H   -4.358200      -2.643300       1.034100    
 H   -3.950100      -1.001400      -1.500500    
 H   -5.210300     -0.4535000      -2.605700    
 H   -2.848400       2.204500      -1.626600    


%chk=000133840-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000133840

0 1
O 5.855200 2.211630 -0.566969
O 4.787369 -3.177000 -0.303760
O 2.286608 -4.107561 -0.553847
O -2.967582 2.038669 -1.442160
O -4.811355 2.276449 -0.055900
C 3.536985 2.755179 -0.259295
C 2.165562 2.460675 0.386726
C 4.597107 1.671064 0.011345
C 1.126890 3.570234 0.108211
C 3.750661 -2.138967 -0.574476
C 2.464881 -2.768733 0.019474
C -0.264401 3.265002 0.708420
C 4.265237 0.340073 -0.624718
C 4.125032 -0.825840 0.061194
C 1.197061 -1.957942 -0.305018
C -1.293532 4.385767 0.440007
C -0.047108 -2.537331 0.334862
C -0.843106 -1.862784 1.203757
C -2.108370 -2.414530 1.844936
C -5.560520 -0.776269 0.749063
C -5.773823 -0.412432 -0.749704
C -3.285820 -1.471860 1.655255
C -4.422567 -1.753153 0.966416
C -4.536140 0.214957 -1.421673
C -4.172599 1.584287 -0.880936
H 3.425978 2.869999 -1.355677
H 3.938818 3.713701 0.123124
H 1.773561 1.494302 0.008703
H 2.287411 2.341292 1.483942
H 4.715774 1.534332 1.109535
H 1.498994 4.534538 0.513087
H 1.027839 3.711066 -0.988551
H 3.617835 -2.021462 -1.671279
H 2.597474 -2.843852 1.121442
H -0.636343 2.305224 0.294203
H -0.166655 3.114275 1.802586
H 4.128862 0.361030 -1.717545
H 4.271470 -0.846210 1.152343
H 1.340581 -0.911894 0.025685
H 1.082740 -1.949900 -1.408902
H -1.397760 4.580104 -0.647969
H -2.288871 4.140233 0.857700
H -0.971551 5.339697 0.897583
H -0.283652 -3.575256 0.061301
H 6.564626 1.525265 -0.471285
H 5.653334 -2.877526 -0.677077
H 3.173701 -4.553938 -0.501828
H -0.583014 -0.825020 1.471884
H -1.931035 -2.553279 2.933997
H -2.339811 -3.411920 1.426875
H -6.507201 -1.212391 1.128215
H -5.380659 0.150816 1.322928
H -6.043391 -1.326859 -1.314321
H -6.630786 0.282891 -0.826364
H -3.177614 -0.471432 2.106072
H -4.532774 -2.748384 0.504248
H -3.650168 -0.437231 -1.304554
H -4.692087 0.324635 -2.513018
H -2.746594 2.937666 -1.071594


