%chk=000079658.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000079658

0 1
 O   -2.795300      3.2099999E-02  0.4098000    
 C   -1.538600      -2.496700      8.0300003E-02
 C   -1.470500       2.525500      7.7900000E-02
 C  -0.8150000      -1.203200     -0.1010000    
 C  -0.7821000       1.212500     -0.1023000    
 C   -1.474000      1.4000000E-02  7.1999997E-02
 C    1.212300     -2.3100000E-02 -0.6183000    
 C   0.5359000      -1.221800     -0.4481000    
 C   0.5688000       1.194000     -0.4495000    
 C  -0.5925000      -3.711500     -0.1672000    
 C   -2.733400      -2.618900     -0.9146000    
 C   -2.152200      -2.727400       1.500300    
 C   -2.686600       2.779600     -0.8722000    
 C   -2.034100       2.672900       1.524500    
 C  -0.4918000       3.713900     -0.1707000    
 C    2.672200     -4.2599998E-02 -0.9930000    
 C    3.573600     -5.4200001E-02  0.2436000    
 C    5.051100     -3.7400000E-02 -0.1479000    
 C    5.952000     -7.7999998E-03   1.076400    
 H    1.110700      -2.128100     -0.5936000    
 H    1.167200       2.084300     -0.5986000    
 H    2.881400     -0.9191000      -1.619800    
 H    2.902000      0.8291000      -1.619600    
 H   0.2345000      -3.747300      0.5521000    
 H  -0.1961000      -3.727500      -1.189600    
 H   -1.141400      -4.654600     -4.7200002E-02
 H   -2.399000      -2.445800      -1.944600    
 H   -3.170500      -3.624100     -0.8768000    
 H   -3.546000      -1.917200     -0.7085000    
 H   -2.529200      -3.751600       1.607400    
 H   -1.394300      -2.566900       2.275700    
 H   -2.993500      -2.064600       1.716000    
 H   -3.097800       3.786200     -0.7329000    
 H   -2.378300       2.683800      -1.919900    
 H   -3.504700       2.072500     -0.7085000    
 H   -1.269900       2.421200       2.269300    
 H   -2.347600       3.706700       1.715200    
 H   -2.910500       2.049600       1.717300    
 H   -1.008800       4.671400     -2.5400000E-02
 H   0.3452000       3.717100      0.5378000    
 H  -0.1084000       3.729400      -1.198000    
 H    3.363900     -0.9435000      0.8515000    
 H    3.352500      0.8172000      0.8731000    
 H    5.286900     -0.9235000     -0.7485000    
 H    5.262300      0.8413000     -0.7684000    
 H   -2.830600     -4.1600000E-02   1.379200    
 H    5.788000     -0.8887000       1.705200    
 H    5.764200      0.8857000       1.680500    
 H    7.003600      2.2000000E-03  0.7731000    


%chk=000079658-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000079658

0 1
O -2.845659 0.139459 0.476578
C -1.608702 -2.569259 0.098988
C -1.499342 2.654035 0.124108
C -0.846878 -1.224288 -0.087756
C -0.795598 1.286488 -0.080581
C -1.480371 0.045002 0.101115
C 1.240688 -0.013394 -0.658240
C 0.517988 -1.210834 -0.467496
C 0.564533 1.212852 -0.462937
C -0.691443 -3.796501 -0.162448
C -2.785258 -2.686932 -0.925201
C -2.120982 -2.724998 1.569615
C -2.694593 2.797173 -0.868005
C -2.010119 2.779069 1.592874
C -0.538769 3.846646 -0.135199
C 2.719111 -0.040062 -1.018810
C 3.646793 -0.019460 0.228181
C 5.148225 -0.041067 -0.136981
C 6.066614 -0.020203 1.104273
H 1.040481 -2.158874 -0.624848
H 1.123393 2.140548 -0.617982
H 2.950238 -0.946219 -1.613918
H 2.970422 0.831127 -1.656410
H 0.162138 -3.830112 0.538550
H -0.297717 -3.802506 -1.194707
H -1.277576 -4.723527 -0.022810
H -2.386634 -2.677840 -1.955514
H -3.326897 -3.639041 -0.771768
H -3.527256 -1.869070 -0.869631
H -2.634746 -3.697249 1.688269
H -1.267367 -2.695585 2.270374
H -2.826564 -1.940329 1.902667
H -3.187913 3.777025 -0.719869
H -2.339431 2.746339 -1.914333
H -3.440220 2.002685 -0.711611
H -1.166367 2.716268 2.305408
H -2.506535 3.758442 1.733475
H -2.731984 1.983137 1.832240
H -1.090660 4.790761 0.026548
H 0.325262 3.842350 0.555295
H -0.159473 3.856491 -1.174122
H 3.407505 -0.889453 0.872977
H 3.423296 0.883761 0.831425
H 5.363404 -0.944536 -0.744035
H 5.378553 0.829762 -0.784719
H -3.229412 -0.760625 0.598455
H 5.875052 -0.896043 1.752507
H 5.891497 0.888852 1.709951
H 7.134874 -0.036764 0.819559


