%chk=000159930.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159930

0 1
 O    3.415500      -2.181600      0.8031000    
 O   -2.994000      -1.413900      -1.735000    
 O   -4.181100      0.4976000      -1.330400    
 C    1.600100     -0.6557000      0.1045000    
 C   0.8828000      0.6673000      0.5898000    
 C  -0.6579000      0.8140000      0.2074000    
 C   -1.383700     -0.5377000      0.5525000    
 C    2.102500     -0.5253000      -1.346400    
 C   0.7156000      -1.896600      0.2945000    
 C    3.216500      0.5090000      -1.205500    
 C    2.974800     -0.8275000      0.8478000    
 C    1.736400       1.937900      0.3077000    
 C  -0.7234000      -1.720200     -0.1743000    
 C   -2.943000     -0.5034000      0.4635000    
 C   -1.298000       1.925500       1.098900    
 C    2.593200       1.885400     -0.9652000    
 C    3.922900      2.0099999E-02  3.4400001E-02
 C  -0.8401000       1.235900      -1.268700    
 C   -3.491700      0.6733000       1.299000    
 C   -2.820500       2.007500       1.001700    
 C   -3.572700      -1.798100       1.020800    
 C   -3.447600     -0.4041000     -0.9541000    
 C    5.193400      0.2909000      0.3541000    
 H   0.8675000      0.5823000       1.688800    
 H   -1.182900     -0.7097000       1.623600    
 H    1.342900     -0.2175000      -2.063700    
 H    2.511200      -1.477500      -1.712100    
 H   0.6942000      -2.161200       1.360400    
 H    1.143600      -2.762200     -0.2268000    
 H    3.864800      0.5166000      -2.087500    
 H    2.928600     -0.5011000       1.892400    
 H    1.137000       2.851700      0.2942000    
 H    2.417200       2.071700       1.160400    
 H   -1.246300      -2.658000      3.4400001E-02
 H  -0.7142000      -1.593700      -1.259400    
 H  -0.8957000       2.911800      0.8439000    
 H   -1.033000       1.747900       2.149800    
 H    1.984600       2.159300      -1.834300    
 H    3.379900       2.646900     -0.8929000    
 H  -0.5834000      0.4461000      -1.973900    
 H   -1.862300       1.531600      -1.505400    
 H  -0.2349000       2.113000      -1.512100    
 H   -3.342600      0.4533000       2.365400    
 H   -4.575900      0.7824000       1.165700    
 H   -3.124500       2.387200      2.1800000E-02
 H   -3.178500       2.749900       1.726000    
 H   -4.666300      -1.715500       1.058400    
 H   -3.354500      -2.684100      0.4165000    
 H   -3.223400      -1.997100       2.040400    
 H    2.937900      -2.668400       1.495900    
 H    5.635500     -9.9299997E-02   1.264300    
 H    5.812100      0.9084000     -0.2879000    
 H   -3.322300      -1.340600      -2.656300    


%chk=000159930-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159930

0 1
O 3.516703 -2.121227 0.974751
O -3.100940 -1.353413 -1.867315
O -4.345911 0.524078 -1.377290
C 1.605638 -0.647623 0.112262
C 0.864759 0.653757 0.602666
C -0.662323 0.808954 0.183568
C -1.389770 -0.548318 0.526431
C 2.102976 -0.524089 -1.360743
C 0.740610 -1.899087 0.371005
C 3.232615 0.531603 -1.231103
C 2.987234 -0.740528 0.877822
C 1.748075 1.923471 0.336953
C -0.699489 -1.751232 -0.157021
C -2.968955 -0.508945 0.432244
C -1.282901 1.922244 1.095359
C 2.573673 1.918424 -0.978979
C 3.973326 0.050907 0.015327
C -0.844948 1.227044 -1.301596
C -3.490958 0.657970 1.321558
C -2.822639 2.012639 1.017223
C -3.570131 -1.842861 0.983269
C -3.531122 -0.344010 -0.985668
C 5.279039 0.235575 0.314611
H 0.810423 0.547169 1.711942
H -1.226592 -0.692723 1.622137
H 1.326290 -0.220691 -2.080014
H 2.516987 -1.498877 -1.683074
H 0.686653 -2.094159 1.467393
H 1.226550 -2.779199 -0.091672
H 3.892323 0.579244 -2.115967
H 2.890210 -0.327306 1.906596
H 1.129638 2.838719 0.378344
H 2.468115 2.016992 1.173603
H -1.254272 -2.682779 0.053268
H -0.699132 -1.638625 -1.255059
H -0.852363 2.908375 0.835888
H -0.991653 1.715799 2.147805
H 1.939773 2.164432 -1.852799
H 3.354167 2.701105 -0.912929
H -0.613768 0.410012 -2.004703
H -1.878304 1.553926 -1.507115
H -0.188245 2.080251 -1.544355
H -3.290598 0.379407 2.376883
H -4.587043 0.744107 1.205854
H -3.149344 2.367456 0.022900
H -3.178815 2.766239 1.746661
H -4.665609 -1.747715 1.099214
H -3.369048 -2.698810 0.319984
H -3.138363 -2.054628 1.979120
H 2.913341 -2.643353 1.564928
H 5.718837 -0.177994 1.229008
H 5.953212 0.776733 -0.360555
H -3.541633 -1.203941 -2.748521


