%chk=000178980.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000178980

0 1
 O   0.7052000      -1.662200      4.4000000E-03
 O   0.7367000      0.3768000      -1.193700    
 O   0.7415000      0.3846000       1.187400    
 O   -5.386700      5.2200001E-02  2.6000000E-03
 C    2.742000     -0.3287000     -4.9000001E-03
 C    2.136900      -1.742500      1.3000000E-03
 C    2.169800      0.3881000      -1.239600    
 C    2.174800      0.3967000       1.227200    
 C    4.263500     -0.3530000     -7.7999998E-03
 C   0.2775000     -0.2881000     -9.9999997E-05
 C    4.844500       1.058600      2.4800001E-02
 C   -1.239100     -0.1969000      1.0000000E-03
 C    6.364200       1.034800     -6.2000002E-03
 C   -2.012200      -1.360500      5.9000002E-03
 C   -1.866900       1.051100     -3.8000001E-03
 C   -3.404600      -1.276500      6.0999999E-03
 C   -3.259200       1.135100     -3.5000001E-03
 C   -4.028100     -2.8700000E-02  1.4000000E-03
 C   -5.959400       1.359100     -2.4999999E-03
 H    2.440000      -2.315600     -0.8819000    
 H    2.443800      -2.309700      0.8870000    
 H    2.464500       1.439300      -1.297700    
 H    2.480900     -9.8399997E-02  -2.170600    
 H    2.490700     -8.1600003E-02   2.160800    
 H    2.466900       1.449300       1.274200    
 H    4.626500     -0.8789000     -0.9000000    
 H    4.630000     -0.9169000      0.8595000    
 H    4.547500       1.589800      0.9338000    
 H    4.510000       1.650200     -0.8318000    
 H    6.766100      0.4914000      0.8550000    
 H    6.730700      0.5527000     -0.9182000    
 H    6.761200       2.054600      2.1100000E-02
 H   -1.564100      -2.349600      9.7000003E-03
 H   -1.280000       1.966200     -7.7000000E-03
 H   -3.998700      -2.186300      9.9999998E-03
 H   -3.678300       2.135500     -7.1999999E-03
 H   -5.699800       1.915600      0.9045000    
 H   -7.047400       1.235300     -1.2000001E-03
 H   -5.701200       1.908000     -0.9144000    


%chk=000178980-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000178980

0 1
O 0.678539 -1.590282 -0.007227
O 0.707784 0.492248 -1.199042
O 0.706918 0.483050 1.200739
O -5.519492 -0.054808 -0.005948
C 2.763718 -0.222870 -0.001064
C 2.164874 -1.652123 0.006740
C 2.201109 0.498263 -1.249133
C 2.200321 0.512295 1.238442
C 4.310508 -0.308917 -0.000065
C 0.214217 -0.209876 -0.001871
C 5.074624 1.037632 0.002443
C -1.291824 -0.165859 -0.002215
C 6.604003 0.825829 -0.000797
C -2.068169 -1.348956 -0.015558
C -1.937429 1.089153 0.010213
C -3.472216 -1.276980 -0.016385
C -3.346285 1.176801 0.009534
C -4.115351 -0.014059 -0.003909
C -6.232514 1.224014 0.006484
H 2.483839 -2.220084 -0.888410
H 2.469813 -2.204335 0.916691
H 2.521690 1.555389 -1.290481
H 2.509916 -0.014371 -2.180861
H 2.521792 0.019824 2.176564
H 2.507549 1.574142 1.259420
H 4.628191 -0.895357 -0.887938
H 4.626866 -0.897517 0.886880
H 4.792469 1.633670 0.892249
H 4.789460 1.638819 -0.882922
H 6.929254 0.255288 0.889463
H 6.926477 0.262665 -0.896738
H 7.142055 1.790892 0.002369
H -1.563134 -2.318091 -0.025025
H -1.333538 2.001482 0.020960
H -4.089772 -2.180052 -0.026521
H -3.823220 2.161253 0.019545
H -5.997924 1.808076 0.917793
H -7.299949 0.957720 0.002292
H -5.995470 1.826932 -0.891812


