%chk=000081491.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000081491

0 1
 O   0.8407000     -3.8000001E-03  1.8400000E-02
 O   -4.054700      0.1498000     -0.2443000    
 O   -1.556400       2.437800      0.3089000    
 O    2.174400      4.4199999E-02  -1.857100    
 C   -1.626200     -3.5999999E-03  4.4700000E-02
 C   -1.729500      -1.282600      0.9288000    
 C  -0.3244000      1.7600000E-02 -0.7960000    
 C   -2.816900      9.7000003E-02 -0.9415000    
 C   -1.644300       1.207900       1.017700    
 C   -1.737700      -2.607800      0.1766000    
 C    2.035100      1.2800000E-02 -0.6426000    
 C    3.157700     -1.4100000E-02  0.3362000    
 C    2.877700     -5.2000001E-02   1.807300    
 C    4.404600     -3.1000001E-03 -0.1573000    
 H   -2.631700      -1.235300       1.551500    
 H  -0.8862000      -1.302600       1.631800    
 H  -0.2966000      0.9164000      -1.425400    
 H  -0.3012000     -0.8439000      -1.474300    
 H   -2.746800       1.009500      -1.543800    
 H   -2.845400     -0.7421000      -1.644300    
 H  -0.8155000       1.165400       1.733700    
 H   -2.571300       1.230700       1.600900    
 H  -0.8197000      -2.753500     -0.3990000    
 H   -1.808900      -3.435500      0.8905000    
 H   -2.593200      -2.686400     -0.4993000    
 H   -4.235800     -0.7390000      0.1047000    
 H  -0.6364000       2.543700      1.3900000E-02
 H    2.306300      0.8309000       2.112400    
 H    2.303900     -0.9480000       2.066200    
 H    3.799100     -6.8599999E-02   2.399300    
 H    5.265000     -2.1500001E-02  0.5046000    
 H    4.613300      2.4200000E-02  -1.221500    


%chk=000081491-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000081491

0 1
O 0.818461 0.563001 -0.170471
O -4.111328 -0.253372 0.083269
O -1.244905 2.284724 1.025212
O 1.666517 -1.444944 -1.013235
C -1.598872 -0.042116 0.097639
C -1.485015 -1.516283 0.585570
C -0.473803 0.342011 -0.889654
C -2.936858 0.216012 -0.661131
C -1.552264 0.885057 1.351763
C -1.643786 -2.606235 -0.499505
C 1.818233 -0.415128 -0.311179
C 3.044813 -0.044450 0.470124
C 3.049004 1.242133 1.269871
C 4.099223 -0.904577 0.411596
H -2.235406 -1.669212 1.387758
H -0.498609 -1.649144 1.070557
H -0.689263 1.315901 -1.360168
H -0.317712 -0.428690 -1.662278
H -3.088427 1.304352 -0.760276
H -2.907980 -0.234877 -1.676236
H -0.819436 0.487792 2.083803
H -2.551104 0.905228 1.818687
H -0.816945 -2.564455 -1.229759
H -1.621906 -3.609687 -0.037437
H -2.597380 -2.522923 -1.056647
H -4.127670 -1.243418 0.070314
H -0.279087 2.334510 0.804249
H 2.885473 2.117619 0.615931
H 2.237344 1.247947 2.020120
H 4.010256 1.372190 1.794711
H 5.029270 -0.703519 0.953896
H 4.038163 -1.820947 -0.185393


