%chk=000114687.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000114687

0 1
 O  -3.3500001E-02   2.968500     -0.6868000    
 O   1.8700000E-02  -2.125000     -5.7999998E-02
 O  -6.4199999E-02   2.173300      -1.899900    
 C   -2.542700     -0.9398000      6.0000001E-03
 C    2.563400     -0.9052000     -3.7000000E-03
 C   -1.276200     -0.1486000      0.1124000    
 C    1.286900     -0.1309000      0.1076000    
 C  -9.1000004E-03   2.013000      0.3767000    
 C   1.0500000E-02 -0.9011000      4.8300002E-02
 C   -1.257000       1.184200      0.2576000    
 C    1.249700       1.201500      0.2531000    
 C   -3.756100      1.6000000E-03  9.1200002E-02
 C   -2.606200      -1.957800       1.155900    
 C   -2.581300      -1.686600      -1.338200    
 C    3.764400      5.2200001E-02  7.8599997E-02
 C    2.594500      -1.646300      -1.350000    
 C    2.657200      -1.926500       1.142500    
 C  -1.8999999E-02   2.773500       1.706800    
 H   -2.165000       1.776300      0.3037000    
 H    2.148700       1.807200      0.2951000    
 H   -3.786700      0.7258000     -0.7319000    
 H   -3.811800      0.5316000       1.049900    
 H   -4.686100     -0.5769000      1.5300000E-02
 H   -2.426800      -1.477900       2.125600    
 H   -3.602400      -2.415200       1.204500    
 H   -1.901900      -2.788100       1.056900    
 H   -1.852200      -2.497600      -1.416600    
 H   -2.411300      -1.002300      -2.178300    
 H   -3.565200      -2.147200      -1.491500    
 H    3.816800      0.5814000       1.037800    
 H    3.781700      0.7782000     -0.7433000    
 H    4.701900     -0.5134000     -3.1000001E-03
 H    2.397800     -0.9639000      -2.185800    
 H    3.585400      -2.085400      -1.520500    
 H    1.882900      -2.473500      -1.419800    
 H    1.957000      -2.761400       1.053600    
 H    2.489400      -1.450000       2.115900    
 H    3.657800      -2.375600       1.172600    
 H  -1.0600000E-02   2.095300       2.567800    
 H   0.8497000       3.438700       1.784800    
 H  -0.9023000       3.419100       1.785600    
 H   0.8468000       2.373300      -2.175100    


%chk=000114687-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000114687

0 1
O -0.019507 3.090382 -0.666475
O 0.021752 -2.185003 -0.137003
O -0.131408 2.442046 -2.038642
C -2.624051 -0.966656 0.022338
C 2.646909 -0.929466 0.007702
C -1.298879 -0.176455 0.125611
C 1.312000 -0.155409 0.108483
C -0.010125 1.993182 0.396733
C 0.008706 -0.919709 0.026604
C -1.267735 1.179797 0.285844
C 1.261153 1.199893 0.275978
C -3.857113 -0.032934 0.145897
C -2.704039 -2.022245 1.168374
C -2.704000 -1.681396 -1.362517
C 3.869826 0.019035 0.120827
C 2.734100 -1.661583 -1.367625
C 2.740779 -1.971832 1.165379
C -0.011265 2.868870 1.676269
H -2.192129 1.764695 0.327067
H 2.179364 1.795305 0.338052
H -3.891291 0.716108 -0.667018
H -3.880565 0.497418 1.116747
H -4.775982 -0.642609 0.076590
H -2.662975 -1.532166 2.159581
H -3.662479 -2.570249 1.098254
H -1.880168 -2.749017 1.097214
H -1.889391 -2.412468 -1.479779
H -2.646032 -0.946547 -2.186886
H -3.669468 -2.215186 -1.445530
H 3.891896 0.555009 1.088412
H 3.894335 0.765017 -0.696104
H 4.795357 -0.580160 0.050483
H 2.676033 -0.939970 -2.204362
H 3.701964 -2.192201 -1.441393
H 1.922095 -2.396386 -1.476906
H 1.926729 -2.709849 1.099878
H 2.691339 -1.472173 2.151237
H 3.706777 -2.507111 1.101615
H 0.002313 2.223050 2.570533
H 0.877159 3.523777 1.695044
H -0.916132 3.499647 1.702919
H 0.827747 2.434050 -2.326123


