%chk=000227101.chk
%nprocshared=4
%mem=3800MB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000227101

0 1
 O   -4.554800     -0.6016000       1.604400    
 O  -0.2859000       2.439400     -0.5487000    
 O   -6.136600      0.7920000      -1.038800    
 O    5.729700     -0.4155000     -6.4800002E-02
 O    6.526300       1.060800       1.523500    
 C   -2.987900      0.2631000     -0.1853000    
 C   -2.243700      -1.015300      0.3027000    
 C   -4.393400      4.1299999E-02  0.3343000    
 C   -4.581400      -1.440900      0.4424000    
 C  -0.8406000      -1.124500     -0.2944000    
 C   -3.280000      -2.134200      0.1055000    
 C  -1.1100000E-02  0.1130000      0.1886000    
 C    1.469300      6.6699997E-02 -0.3362000    
 C   -2.253600       1.466500      0.3891000    
 C    2.081600      -1.302300      0.1216000    
 C  -0.1648000      -2.442100      9.9799998E-02
 C  -0.7953000       1.427900     -6.8599999E-02
 C   -3.085500      0.3950000      -1.726700    
 C    1.281800      -2.509500     -0.3801000    
 C   -5.523000      0.9237000      1.3000000E-02
 C    2.331400       1.188300      0.3162000    
 C    3.568700      -1.440300     -0.2287000    
 C    1.508900      0.2262000      -1.877100    
 C    3.828200       1.064900      2.0199999E-02
 C    4.384200     -0.3066000      0.3874000    
 C   -5.853900       1.966200       1.040300    
 C    6.599300      0.5151000      0.4308000    
 C    7.682000      0.7828000     -0.5702000    
 H   -2.107500     -0.9390000       1.395400    
 H   -5.493300      -1.929400      0.1449000    
 H  -0.9198000      -1.118200      -1.385900    
 H   -3.295500      -2.494700     -0.9279000    
 H   -3.097300      -2.980600      0.7741000    
 H   4.7400001E-02  5.9500001E-02   1.287600    
 H   -2.269300       1.473700       1.485000    
 H   -2.710400       2.404000      5.2099999E-02
 H    2.024300      -1.332000       1.221300    
 H  -0.7179000      -3.290200     -0.3204000    
 H  -0.1877000      -2.560700       1.190800    
 H   -3.595800     -0.4617000      -2.179900    
 H   -3.650300       1.292000      -2.006800    
 H   -2.107400      0.4870000      -2.208100    
 H    1.732300      -3.436500     -4.3000001E-03
 H    1.313300      -2.572200      -1.473700    
 H    2.189700       1.168800       1.405000    
 H    2.010400       2.179300     -1.8400000E-02
 H    3.957700      -2.396600      0.1453000    
 H    3.722400      -1.477000      -1.313900    
 H   0.9052000     -0.5240000      -2.393700    
 H    1.137600       1.207200      -2.188400    
 H    2.522100      0.1381000      -2.278900    
 H    4.026900       1.278700      -1.037300    
 H    4.345600       1.858700      0.5708000    
 H    4.370500     -0.4300000       1.478800    
 H   -6.476000       1.523900       1.822200    
 H   -4.940900       2.375400       1.480000    
 H   -6.400000       2.784500      0.5628000    
 H    7.244900       1.174500      -1.492100    
 H    8.239400     -0.1362000     -0.7679000    
 H    8.372200       1.529500     -0.1673000    


%chk=000227101-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000227101

0 1
O -4.364192 -0.350881 1.892155
O -0.277501 2.490032 -1.020295
O -5.399201 2.188294 -0.518026
O 5.834584 -0.256864 -0.287062
O 6.633569 0.944051 1.551859
C -2.977811 0.433594 -0.156246
C -2.217967 -0.836444 0.361109
C -4.372344 0.246656 0.480688
C -4.557634 -1.246476 0.697338
C -0.839669 -1.014433 -0.296107
C -3.273751 -1.974587 0.294021
C 0.033314 0.263587 0.025973
C 1.496753 0.174669 -0.537646
C -2.164910 1.680856 0.271785
C 2.131503 -1.143681 0.047916
C -0.129354 -2.294088 0.207013
C -0.745108 1.561415 -0.307083
C -3.170936 0.430506 -1.701262
C 1.319806 -2.407930 -0.309870
C -5.520017 1.209807 0.270718
C 2.346074 1.371175 0.006047
C 3.629713 -1.289713 -0.316755
C 1.492965 0.185838 -2.091566
C 3.855114 1.249680 -0.319923
C 4.421470 -0.081936 0.196877
C -6.787049 0.984901 1.079144
C 6.845624 0.327278 0.481715
C 8.194878 0.115563 -0.172718
H -2.035442 -0.664939 1.442248
H -5.536523 -1.736724 0.653774
H -0.956284 -1.097094 -1.394730
H -3.388120 -2.392836 -0.724850
H -3.048208 -2.807975 0.982435
H 0.118890 0.272503 1.140640
H -2.112592 1.721119 1.378628
H -2.615918 2.616268 -0.099212
H 2.079894 -1.036748 1.157672
H -0.714008 -3.184006 -0.098942
H -0.118988 -2.284185 1.318217
H -3.686966 -0.483067 -2.048941
H -3.770891 1.302884 -2.004822
H -2.201163 0.491735 -2.225244
H 1.806173 -3.297366 0.137639
H 1.324325 -2.568020 -1.406614
H 2.219193 1.423719 1.109303
H 1.960294 2.317570 -0.407190
H 4.033819 -2.216988 0.133196
H 3.762664 -1.380648 -1.411492
H 0.865678 -0.617998 -2.516356
H 1.104872 1.151352 -2.455598
H 2.508604 0.052263 -2.501313
H 4.017607 1.310137 -1.412529
H 4.403773 2.090816 0.141586
H 4.449160 -0.069572 1.304328
H -7.189941 -0.033208 0.924891
H -6.563644 1.070815 2.157566
H -7.541775 1.730453 0.786596
H 8.297655 0.797941 -1.036002
H 8.286588 -0.915016 -0.552367
H 8.996051 0.331849 0.549083


