%chk=000089603.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089603

0 1
 O    5.926100      0.4494000     -0.2006000    
 O    4.697000     -0.2682000       1.613800    
 O    8.462800       1.530200     -0.7058000    
 C   -2.841300     -1.7300000E-02 -0.2245000    
 C   -1.759600      -1.073400      1.3600000E-02
 C   -4.232100     -0.5656000      0.1030000    
 C  -0.3652000     -0.5179000     -0.2819000    
 C   -5.352000      0.4611000     -8.8299997E-02
 C   0.7133000      -1.584200     -7.5300001E-02
 C   -6.749500     -0.1072000      0.1681000    
 C    2.103000      -1.037200     -0.4031000    
 C   -7.832000      0.9389000     -0.1072000    
 C    3.240800      -2.043300     -0.1900000    
 C   -9.227200      0.3841000      0.1792000    
 C    4.635400      -1.490000     -0.4865000    
 C   -10.30320       1.431000     -6.0899999E-02
 C    5.057300     -0.3794000      0.4499000    
 C    6.442000       1.533900      0.5777000    
 C    7.384400       2.354900     -0.2811000    
 H   -2.640700      0.8626000      0.3986000    
 H   -2.813300      0.3127000      -1.269900    
 H   -1.802800      -1.418100       1.053900    
 H   -1.952400      -1.944600     -0.6242000    
 H   -4.249200     -0.9208000       1.140800    
 H   -4.432100      -1.437100     -0.5329000    
 H  -0.1648000      0.3407000      0.3704000    
 H  -0.3277000     -0.1544000      -1.316100    
 H   -5.177100       1.313300      0.5801000    
 H   -5.305100      0.8488000      -1.113700    
 H   0.5043000      -2.452100     -0.7123000    
 H   0.6921000      -1.932600      0.9642000    
 H   -6.818100     -0.4499000       1.207500    
 H   -6.914000     -0.9817000     -0.4729000    
 H    2.120400     -0.7006000      -1.447300    
 H    2.283900     -0.1488000      0.2139000    
 H   -7.773000       1.264900      -1.152800    
 H   -7.653900       1.822800      0.5174000    
 H    3.206400      -2.406500      0.8447000    
 H    3.067400      -2.913800     -0.8345000    
 H   -9.420400     -0.4853000     -0.4599000    
 H   -9.286100      4.2100001E-02   1.219100    
 H    5.378500      -2.290500     -0.4027000    
 H    4.654000      -1.116400      -1.517200    
 H   -10.15730       2.300000      0.5887000    
 H   -10.29230       1.773200      -1.100600    
 H   -11.29260       1.012600      0.1487000    
 H    6.985800       1.120800       1.435200    
 H    5.615100       2.160600      0.9290000    
 H    6.871000       2.721200      -1.175700    
 H    7.786700       3.201300      0.2831000    
 H    9.046400       2.083600      -1.252400    


%chk=000089603-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000089603

0 1
O 6.111317 0.526142 -0.243279
O 4.700176 -0.050056 1.516688
O 8.998164 1.282687 -0.029994
C -2.954377 -0.048122 -0.336374
C -1.804102 -1.038492 -0.046379
C -4.344264 -0.582847 0.076162
C -0.413681 -0.495588 -0.445999
C -5.492662 0.411071 -0.209346
C 0.738012 -1.483979 -0.155211
C -6.882395 -0.119150 0.210014
C 2.128988 -0.924747 -0.527539
C -8.029508 0.877931 -0.069873
C 3.274086 -1.921965 -0.241130
C -9.419163 0.348601 0.352398
C 4.671500 -1.365881 -0.587771
C -10.558547 1.352631 0.072765
C 5.117231 -0.256635 0.353415
C 6.697637 1.597057 0.609319
C 7.861842 2.205255 -0.151782
H -2.757081 0.906204 0.195821
H -2.962655 0.197039 -1.419297
H -1.801027 -1.289193 1.035124
H -1.995859 -1.990492 -0.584825
H -4.334557 -0.829476 1.158658
H -4.543908 -1.536147 -0.457018
H -0.223011 0.454730 0.095380
H -0.415910 -0.241924 -1.527046
H -5.289987 1.365420 0.320798
H -5.505204 0.655119 -1.292455
H 0.558296 -2.429588 -0.709292
H 0.730399 -1.747953 0.922735
H -6.868360 -0.366060 1.292464
H -7.087445 -1.071781 -0.322375
H 2.138540 -0.649131 -1.603350
H 2.308832 0.007898 0.043676
H -8.046297 1.124480 -1.152398
H -7.824963 1.831115 0.461708
H 3.255170 -2.200166 0.830086
H 3.107920 -2.850962 -0.821855
H -9.623852 -0.602459 -0.180801
H -9.400623 0.100021 1.433358
H 5.433859 -2.168247 -0.518369
H 4.716011 -0.988877 -1.625867
H -10.395380 2.299624 0.621360
H -10.615699 1.596375 -1.005090
H -11.540845 0.948817 0.380445
H 7.035559 1.162403 1.566069
H 5.914429 2.349141 0.817498
H 7.568341 2.363985 -1.209997
H 8.105053 3.189731 0.303998
H 9.699101 1.524242 -0.684929


