%chk=000134939.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000134939

0 1
 O    2.239600      1.8900000E-02  -2.421100    
 O    3.895900     -0.4703000     -0.2372000    
 O   4.3600000E-02   1.619200      -2.011100    
 O    3.237400      0.6753000       2.137000    
 O    1.783300      -2.688400       1.242500    
 O   0.8454000      -4.166400     -0.2015000    
 C   -4.239100       1.135800      0.4397000    
 C   -4.537100     -0.1019000     -0.4202000    
 C   -3.090300       1.981100     -7.9700001E-02
 C  -0.7303000       2.893800      0.3225000    
 C   0.4759000       2.016800      0.2948000    
 C   -1.974400       2.127000      0.6622000    
 C    1.274100       1.762900       1.348400    
 C   -3.329100     -0.9833000     -0.5924000    
 C   -2.972700      -2.061900      0.1335000    
 C   -1.711300      -2.871300     -8.9100003E-02
 C   0.7717000       1.418400      -1.042400    
 C   -3.306800       2.593300      -1.436400    
 C    2.485300      0.9014000       1.192100    
 C    1.970700      0.5625000      -1.180500    
 C    2.769500      0.3220000     -0.1393000    
 C  -0.5037000      -2.346400      0.6922000    
 C    1.051900       2.271300       2.747500    
 C   -3.841900      -2.506700       1.281000    
 C   0.7519000      -3.168200      0.4993000    
 C    1.614000      -1.241300      -2.561800    
 C    5.026500      0.3063000     -0.5805000    
 H   -5.140000       1.760600      0.4871000    
 H   -4.047300      0.8125000       1.471200    
 H   -5.382800     -0.6511000      6.6000000E-03
 H   -4.878300      0.2057000      -1.416800    
 H  -0.8168000       3.445700     -0.6177000    
 H  -0.6116000       3.689200       1.068300    
 H   -1.949000       1.637000       1.635700    
 H   -2.661100     -0.6890000      -1.401600    
 H   -1.467900      -2.869800      -1.160200    
 H   -1.900200      -3.922800      0.1621000    
 H   -3.231400       1.832200      -2.218900    
 H   -2.595600       3.386700      -1.673900    
 H   -4.303100       3.045600      -1.490300    
 H  -0.2824000      -1.319500      0.3805000    
 H  -0.7334000      -2.341000       1.764100    
 H    1.845200       2.973800       3.023600    
 H   9.5100001E-02   2.780800       2.881800    
 H    1.062600       1.439400       3.460500    
 H   -4.372900      -3.425500       1.011400    
 H   -3.220300      -2.720900       2.157800    
 H   -4.577500      -1.768600       1.607200    
 H    2.068000      -1.981400      -1.895100    
 H    1.765100      -1.582700      -3.590300    
 H   0.5344000      -1.183300      -2.383000    
 H    5.894200     -0.3585000     -0.6276000    
 H    5.231700       1.073300      0.1744000    
 H    4.907500      0.7723000      -1.564900    
 H    2.595600      -3.227100       1.131400    


%chk=000134939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000134939

0 1
O 2.408079 -0.053722 -2.321786
O 3.439126 -0.773892 0.100617
O 0.400934 2.022647 -2.354623
O 3.111963 1.022792 2.260170
O 1.600522 -2.563931 0.879936
O 0.251720 -1.725084 -0.816216
C -3.910584 1.112967 0.656116
C -4.353722 -0.242693 0.016632
C -2.883815 1.926241 -0.131424
C -0.659426 3.277755 -0.045945
C 0.608593 2.440189 0.010479
C -1.799821 2.435956 0.522031
C 1.366715 2.270897 1.148460
C -3.252251 -1.253887 -0.242716
C -3.014450 -2.413789 0.437730
C -1.963520 -3.411343 -0.056301
C 0.968014 1.722441 -1.255774
C -3.187497 2.151227 -1.600264
C 2.453723 1.233325 1.182885
C 2.028872 0.653410 -1.213787
C 2.683520 0.408814 -0.018315
C -0.630470 -3.434969 0.737471
C 1.131685 3.003306 2.447863
C -3.779847 -2.856555 1.674841
C 0.418553 -2.481152 0.176259
C 1.453443 -0.379617 -3.416978
C 4.874748 -0.668193 0.466497
H -4.830914 1.726695 0.773609
H -3.521853 0.919164 1.673857
H -5.133153 -0.677688 0.669742
H -4.855205 -0.023826 -0.948359
H -0.855541 3.569745 -1.089210
H -0.542762 4.201496 0.550813
H -1.687435 2.188545 1.588772
H -2.596148 -1.037584 -1.099445
H -1.727297 -3.206165 -1.115500
H -2.405735 -4.427330 -0.010121
H -3.188809 1.192451 -2.153789
H -2.454032 2.808192 -2.092607
H -4.195902 2.593032 -1.727085
H -0.779287 -3.186011 1.805261
H -0.176894 -4.445070 0.730072
H 2.089661 3.170585 2.967323
H 0.616056 3.964822 2.296441
H 0.515426 2.390999 3.134867
H -4.387595 -3.759245 1.462537
H -3.080264 -3.134440 2.488295
H -4.452586 -2.077544 2.069297
H 0.527704 -0.783471 -2.979215
H 1.980116 -1.154004 -3.994773
H 1.248733 0.511567 -4.027154
H 5.234129 -1.706635 0.519634
H 4.975360 -0.164405 1.440377
H 5.409240 -0.121100 -0.329492
H 2.337979 -1.942411 0.534895


