%chk=000271519.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271519

0 1
O 3.259140 -1.684125 0.020680
O -1.237143 -0.652036 -0.640022
O 2.061678 2.677983 -1.129532
O -0.428738 2.740183 1.505539
O -3.797582 -1.591230 -1.054467
O -5.973979 -0.144881 0.238370
C 0.249064 1.298807 -0.307588
C 1.719164 1.765891 -0.069422
C 2.720109 0.662708 0.077544
C 0.065761 -0.175194 -0.409103
C 2.389879 -0.653109 -0.081565
C 4.704095 -1.424129 0.350846
C -0.730911 1.872926 0.722541
C 1.029228 -1.110119 -0.344218
C 4.096203 0.998863 0.388444
C -2.078745 1.284125 0.602928
C 5.020208 0.032710 0.513381
C -2.281199 0.087726 -0.104645
C 4.890917 -2.205528 1.648038
C 5.427544 -2.047126 -0.839769
C -3.192678 1.925895 1.182421
C -3.565128 -0.473751 -0.270261
C 2.438157 2.099273 -2.393393
C -4.664387 0.208111 0.304185
C -4.466266 1.407164 1.034306
C -3.116798 -2.795338 -0.600373
C -6.348115 -1.343801 -0.496811
H -0.055934 1.762439 -1.298047
H 1.747509 2.470181 0.807322
H 0.850297 -2.178649 -0.446961
H 4.337497 2.057229 0.505500
H 6.059329 0.247071 0.745730
H 4.368543 -1.717830 2.481510
H 5.947533 -2.290936 1.920433
H 4.478619 -3.219000 1.561393
H 6.502613 -2.139286 -0.655523
H 5.292656 -1.443491 -1.745892
H 5.033896 -3.048065 -1.059640
H -3.026965 2.849443 1.749028
H 1.645989 1.455231 -2.781818
H 3.375855 1.543807 -2.288699
H 2.575343 2.983980 -3.026139
H -5.336162 1.899276 1.469425
H -2.032108 -2.667065 -0.701135
H -3.491639 -3.544012 -1.306482
H -3.397158 -3.029356 0.428145
H -5.955112 -2.226498 0.014471
H -5.975539 -1.289195 -1.527013
H -7.442440 -1.294472 -0.452464


%chk=000271519-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271519

0 1
O 3.319616 -1.690631 0.475360
O -1.237901 -0.719949 -0.599584
O 2.161855 2.467452 -1.395230
O -0.394118 2.792843 1.497771
O -3.820345 -1.670651 -0.973091
O -6.040303 -0.133185 0.208339
C 0.273339 1.242566 -0.312982
C 1.741230 1.731358 -0.157675
C 2.741079 0.669226 0.225951
C 0.079506 -0.249427 -0.346840
C 2.420175 -0.676464 0.135960
C 4.805738 -1.342607 0.472474
C -0.713137 1.840087 0.734618
C 1.080386 -1.156467 -0.164206
C 4.039331 1.029980 0.780919
C -2.063768 1.247110 0.666778
C 5.005150 0.081495 0.976700
C -2.296454 0.052242 -0.072204
C 5.433126 -2.393776 1.399954
C 5.295039 -1.494760 -0.986612
C -3.180716 1.900560 1.258201
C -3.599761 -0.483346 -0.246259
C 2.393120 1.613258 -2.563619
C -4.703986 0.233315 0.305391
C -4.475674 1.412279 1.074623
C -3.283602 -2.908187 -0.358121
C -6.536554 -0.999913 -0.882707
H -0.091913 1.663106 -1.278653
H 1.739848 2.550891 0.585076
H 0.893837 -2.232857 -0.196542
H 4.206298 2.073243 1.072947
H 5.960422 0.316163 1.458971
H 5.036599 -2.292072 2.423938
H 6.530139 -2.264868 1.430858
H 5.209579 -3.410778 1.034446
H 6.379911 -1.291671 -1.045600
H 4.777833 -0.774947 -1.645156
H 5.104251 -2.519516 -1.353205
H -2.993571 2.815410 1.828708
H 1.483337 1.047397 -2.858177
H 3.216210 0.892162 -2.390581
H 2.671090 2.300682 -3.378095
H -5.348483 1.918508 1.495428
H -2.182554 -2.871850 -0.313549
H -3.609791 -3.722647 -1.022588
H -3.703911 -3.050335 0.655930
H -6.305992 -2.058487 -0.685892
H -6.098413 -0.706184 -1.850860
H -7.624999 -0.832957 -0.880115


