%chk=000158226.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000158226

0 1
 O    3.085200      0.1949000     -0.1002000    
 O    2.185100     -0.8102000       1.803100    
 O    5.991600       2.081700       2.105400    
 O    5.343600       3.034500     -0.5630000    
 O    3.563000       1.055200       3.417600    
 O    4.341800       1.988200      -2.859300    
 O    3.665500     -0.1917000      -2.487000    
 O   -2.333000     -0.1684000      0.5101000    
 O    2.194300      -3.331500      0.6645000    
 O  -4.4100001E-02  -4.298700     -0.5605000    
 O   -2.529000      -3.850200      -1.223200    
 O   -5.156900       3.955800      3.3000000E-03
 O   -7.776100       3.027800      7.7799998E-02
 C    4.708200       1.951400       1.492000    
 C    4.918200       1.788500     -1.3700000E-02
 C    3.977900      0.7471000       2.086900    
 C    3.622700       1.369300     -0.6973000    
 C    2.736700      0.3923000       1.267800    
 C    3.873700      0.9527000      -2.110400    
 C    1.065600      -1.294000       1.191400    
 C    1.065700      -2.565100      0.6153000    
 C  -8.3999999E-02 -0.5047000       1.146200    
 C   -1.234100     -0.9895000      0.5228000    
 C   -1.232200      -2.259400     -5.1899999E-02
 C  -8.3400004E-02  -3.052900     -8.5000005E-03
 C   -2.458800      -2.746000     -0.7014000    
 C    4.611800       1.681100      -4.230900    
 C   -3.488100     -0.6205000     -0.1093000    
 C   -3.612300      -1.824000     -0.6913000    
 C   -4.610000      0.3386000     -6.0300000E-02
 C    3.116400      -3.195400     -0.4138000    
 C   -4.358700       1.713000     -5.1399998E-02
 C   -5.927700     -0.1239000     -2.2500001E-02
 C   -5.418300       2.618900     -4.9999999E-03
 C   -6.987500      0.7818000      2.4000000E-02
 C   -6.732600       2.153300      3.2699998E-02
 H    4.165200       2.880100       1.707700    
 H    5.717700       1.061300     -0.2019000    
 H    4.651000     -0.1172000       2.150000    
 H    2.863300       2.160900     -0.7057000    
 H    2.000800       1.202400       1.354900    
 H    5.850100       2.271500       3.048000    
 H    4.640200       3.688100     -0.4089000    
 H    4.363200       1.188700       3.952700    
 H  -0.1029000      0.4790000       1.607600    
 H    4.978200       2.589300      -4.716900    
 H    3.695400       1.358300      -4.734100    
 H    5.384100      0.9091000      -4.300800    
 H   -4.512400      -2.170100      -1.185600    
 H  -0.8948000      -4.521300     -0.9677000    
 H    2.609100      -2.996400      -1.363800    
 H    3.674100      -4.131500     -0.5066000    
 H    3.824400      -2.392400     -0.1927000    
 H   -3.341700       2.097400     -8.8500001E-02
 H   -6.167200      -1.183800     -5.5000000E-03
 H   -8.006600      0.4059000      5.7900000E-02
 H   -6.004300       4.432800      3.7300002E-02
 H   -8.609200       2.526200      9.8700002E-02


%chk=000158226-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000158226

0 1
O 3.316544 0.242150 -0.064788
O 2.092416 -0.347867 1.867638
O 6.070427 2.410843 2.253897
O 6.013414 2.751066 -0.610236
O 3.524471 1.668862 3.420370
O 4.015737 1.424198 -3.150190
O 5.216053 -0.347955 -2.224335
O -2.549926 -0.061742 0.510231
O 2.381672 -2.786860 0.643325
O 0.171016 -3.885939 -0.854938
O -2.269785 -3.684357 -1.545672
O -5.752325 3.607099 1.390071
O -8.170404 2.862755 0.447737
C 4.854059 2.143219 1.483743
C 5.319997 1.676886 0.095840
C 3.976359 1.080956 2.156261
C 4.092507 1.293919 -0.761562
C 2.802854 0.731500 1.227348
C 4.518653 0.679879 -2.092981
C 0.986001 -0.880486 1.152067
C 1.168908 -2.128850 0.493145
C -0.243476 -0.186634 1.174215
C -1.320693 -0.754307 0.482548
C -1.200276 -1.984385 -0.215463
C 0.052678 -2.680552 -0.202189
C -2.359139 -2.549657 -0.908380
C 4.400633 0.952847 -4.505402
C -3.666421 -0.585006 -0.152136
C -3.584954 -1.782637 -0.843838
C -4.854855 0.277027 -0.014049
C 3.099673 -3.195010 -0.593037
C -4.745205 1.541552 0.629719
C -6.118063 -0.140196 -0.517330
C -5.870259 2.368173 0.760507
C -7.249426 0.688491 -0.385930
C -7.126668 1.939231 0.249413
H 4.259128 3.077406 1.376368
H 5.971866 0.786885 0.214353
H 4.551892 0.148724 2.327118
H 3.470484 2.191198 -0.951000
H 2.133880 1.606275 1.048176
H 5.799468 2.638502 3.180017
H 6.746160 3.065660 -0.020101
H 3.017073 0.980323 3.920321
H -0.352973 0.752983 1.720435
H 3.947765 1.679811 -5.192955
H 4.006169 -0.062331 -4.678092
H 5.498967 0.940663 -4.600541
H -4.453535 -2.180640 -1.369995
H -0.765451 -4.089233 -1.277516
H 2.451127 -3.816599 -1.231588
H 3.960718 -3.776693 -0.232302
H 3.452006 -2.292460 -1.122139
H -3.787366 1.883130 1.026660
H -6.232512 -1.112428 -1.003355
H -8.219875 0.356675 -0.774158
H -6.637698 4.057691 1.395437
H -9.031589 2.544543 0.085339


