%chk=000171384.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000171384

0 1
 O   -2.023200      -3.442000     -0.7094000    
 C   -1.830200      -2.870800      0.5911000    
 C   -3.172300      -2.859800     -8.1000000E-02
 C  -0.9686000      -1.646100      0.6115000    
 C   -3.659100      -1.631100     -0.7490000    
 C   0.4940000      -1.976500      0.3127000    
 C   -4.326000     -0.6576000      0.2332000    
 C    1.373300     -0.7262000      0.3750000    
 C   -4.865500      0.5884000     -0.4723000    
 C    2.841500      -1.068100      0.1120000    
 C   -5.492800       1.563800      0.5283000    
 C    3.779100      0.1368000      0.2329000    
 C   -5.989300       2.870700     -0.1176000    
 C    5.244700     -0.2001000     -5.5399999E-02
 C    6.130800       1.042400      6.8700001E-02
 C   -7.057400       2.626700      -1.184600    
 C   -6.542100       3.805200      0.9615000    
 C    7.606400      0.7719000     -0.2388000    
 C    8.503200       1.995100     -4.4199999E-02
 C    9.953700       1.677200     -0.3745000    
 H   -1.658300      -3.544800       1.418700    
 H   -3.950200      -3.516500      0.2812000    
 H   -1.043600      -1.197600       1.609700    
 H   -1.290100     -0.8754000     -9.2100002E-02
 H   -4.411500      -1.937600      -1.487900    
 H   -2.886200      -1.122100      -1.334500    
 H   0.8551000      -2.720900       1.033300    
 H   0.5753000      -2.434200     -0.6809000    
 H   -5.144500      -1.169300      0.7548000    
 H   -3.603700     -0.3599000       1.002600    
 H    1.029800      8.2999999E-03 -0.3633000    
 H    1.279300     -0.2604000       1.363400    
 H   -5.606700      0.2760000      -1.215900    
 H   -4.051400       1.088600      -1.010200    
 H    2.936600      -1.498600     -0.8926000    
 H    3.166600      -1.841200      0.8194000    
 H   -6.326100       1.067000       1.041900    
 H   -4.750600       1.808900       1.298900    
 H    3.445300      0.9183000     -0.4610000    
 H    3.695700      0.5547000       1.243900    
 H   -5.137500       3.372300     -0.5941000    
 H    5.333800     -0.6151000      -1.066300    
 H    5.590300     -0.9709000      0.6436000    
 H    6.045000       1.443700       1.086300    
 H    5.763100       1.821700     -0.6105000    
 H   -7.455200       3.576100      -1.559600    
 H   -6.647800       2.089400      -2.045200    
 H   -7.894500       2.045500     -0.7833000    
 H   -5.779200       4.021700       1.716700    
 H   -6.858800       4.758900      0.5260000    
 H   -7.405400       3.360700       1.468600    
 H    7.962700     -4.0399998E-02  0.4070000    
 H    7.695700      0.4155000      -1.272600    
 H    8.436000       2.343500      0.9929000    
 H    8.157500       2.813900     -0.6855000    
 H    10.33790      0.8812000      0.2715000    
 H    10.05770       1.355500      -1.415700    
 H    10.57830       2.564000     -0.2289000    


%chk=000171384-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000171384

0 1
O -1.944417 -3.193044 -0.868598
C -1.713580 -2.539323 0.485847
C -3.086861 -2.524194 -0.127730
C -0.763017 -1.357779 0.515446
C -3.722862 -1.310933 -0.781473
C 0.710067 -1.791548 0.321966
C -4.579273 -0.492673 0.216860
C 1.693964 -0.601394 0.359035
C -5.304496 0.696826 -0.452058
C 3.167705 -1.022609 0.163804
C -6.160247 1.514442 0.542096
C 4.151612 0.168916 0.195941
C -6.817204 2.787121 -0.057462
C 5.626618 -0.247519 -0.000844
C 6.607815 0.946512 0.029971
C -7.849596 2.447268 -1.159900
C -7.477293 3.631286 1.058772
C 8.083807 0.533708 -0.167623
C 9.062798 1.730197 -0.138385
C 10.535055 1.309708 -0.337981
H -1.537645 -3.286104 1.276759
H -3.810141 -3.250329 0.277267
H -0.872254 -0.840374 1.492218
H -1.034733 -0.628566 -0.270069
H -4.359552 -1.656475 -1.620768
H -2.942164 -0.667001 -1.226089
H 0.987485 -2.522924 1.109463
H 0.798472 -2.321864 -0.646421
H -5.330132 -1.156476 0.694266
H -3.931084 -0.116611 1.035018
H 1.415224 0.128082 -0.430155
H 1.590881 -0.066658 1.327034
H -5.940599 0.311244 -1.273970
H -4.553509 1.364421 -0.924469
H 3.270427 -1.557366 -0.803339
H 3.448734 -1.751387 0.952799
H -6.956836 0.865218 0.964608
H -5.518814 1.816732 1.396898
H 3.869094 0.897636 -0.592704
H 4.048030 0.703452 1.163665
H -6.009987 3.396970 -0.518242
H 5.730714 -0.782100 -0.968256
H 5.910656 -0.975477 0.787891
H 6.503384 1.481074 0.997589
H 6.322794 1.674369 -0.758643
H -8.312356 3.366824 -1.564570
H -7.390063 1.903636 -2.004937
H -8.660723 1.814600 -0.748688
H -6.741507 3.920565 1.832652
H -7.925334 4.556581 0.650742
H -8.283691 3.058284 1.556813
H 8.371474 -0.192700 0.621318
H 8.189920 -0.000933 -1.134913
H 8.956045 2.263381 0.828452
H 8.773564 2.455431 -0.926374
H 10.857996 0.609677 0.455803
H 10.671998 0.798628 -1.309866
H 11.214238 2.181975 -0.316067


