%chk=000081586.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081586

0 1
 O    2.795300      -2.143600      5.9099998E-02
 O   -2.661800      0.1560000      0.1612000    
 O   0.1205000      -2.834800      0.1422000    
 O   -2.373800      -2.002200     -0.5860000    
 C    1.237500       1.097200     -0.5966000    
 C  -0.4915000     -0.5653000     -0.3081000    
 C  -0.1138000      0.7545000     -0.5560000    
 C    1.641700       2.508100     -0.8617000    
 C    2.211400      0.1202000     -0.3896000    
 C    1.833700      -1.199500     -0.1419000    
 C   0.4824000      -1.542300     -0.1011000    
 C   -1.908300     -0.9006000     -0.2699000    
 C    1.776000       3.329100      0.3946000    
 C   -4.076000     -5.0999999E-02  0.2432000    
 C   -4.732800       1.221000      0.7354000    
 C    3.229000      -2.351100       1.401700    
 C    1.030400       4.404300      0.6736000    
 H  -0.8580000       1.527800     -0.7325000    
 H    2.603200       2.526100      -1.391400    
 H   0.9271000       2.971800      -1.554700    
 H    3.266600      0.3813000     -0.4193000    
 H    2.541200       3.030300       1.107000    
 H   -4.463600     -0.3098000     -0.7483000    
 H   -4.283700     -0.8704000      0.9402000    
 H  -0.8437000      -2.916600      0.2106000    
 H   -5.816900       1.098100      0.8097000    
 H   -4.340200       1.501700       1.718400    
 H   -4.516600       2.053400      5.7500001E-02
 H    2.393700      -2.672900       2.031800    
 H    3.674400      -1.436700       1.806300    
 H    3.988100      -3.138100       1.398900    
 H    1.184400       4.955800       1.594500    
 H   0.2585000       4.750000     -4.8000002E-03


%chk=000081586-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000081586

0 1
O 3.072485 -2.087367 -0.167118
O -2.592120 0.297303 0.327751
O 0.283153 -2.800886 0.202742
O -2.127431 -1.975784 0.416283
C 1.468583 1.263113 -0.231229
C -0.301044 -0.404038 0.124190
C 0.111850 0.946802 -0.040727
C 1.927033 2.704671 -0.462152
C 2.414902 0.203904 -0.229999
C 2.041434 -1.144889 -0.066744
C 0.659404 -1.473233 0.096071
C -1.715507 -0.765864 0.298332
C 1.200142 3.728377 0.389577
C -4.042806 -0.037764 0.501533
C -4.799126 1.285353 0.482887
C 3.083074 -3.243343 0.756636
C 0.534133 4.808069 -0.091097
H -0.645631 1.735388 -0.020241
H 3.014684 2.765834 -0.254204
H 1.800111 2.970347 -1.530956
H 3.483363 0.409104 -0.362274
H 1.239652 3.557012 1.476329
H -4.340516 -0.713070 -0.320295
H -4.157219 -0.582390 1.455752
H -0.739258 -2.821308 0.305653
H -5.880463 1.095829 0.610496
H -4.463140 1.944536 1.301223
H -4.649699 1.812790 -0.474466
H 2.208537 -3.890179 0.591116
H 3.099421 -2.895445 1.807542
H 4.019221 -3.772900 0.523270
H 0.042372 5.524580 0.576312
H 0.464808 5.007248 -1.168195


