%chk=000181897.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000181897

0 1
O 4.281876 1.370933 -0.430417
O 0.280124 2.434245 -0.352606
C 1.893211 -1.144315 0.646066
C 2.645960 0.181303 0.915257
C 2.532595 -1.765167 -0.629916
C 0.397194 -1.025219 0.467144
C 1.758770 1.388773 1.192211
C 3.345677 -0.671605 -1.325112
C 3.532629 0.436380 -0.314823
C -0.249375 0.177887 0.253098
C 0.552559 1.434701 0.273251
C -0.352737 -2.242592 0.509565
C -1.671721 0.215099 0.042498
C -2.404472 -1.001107 0.098396
C -1.711651 -2.229038 0.337111
C -2.388185 1.427402 -0.217422
C -3.822939 -0.985079 -0.089378
C -3.748447 1.416036 -0.396856
C -4.479874 0.195123 -0.329022
H 2.076867 -1.826617 1.513916
H 3.330592 0.039412 1.789579
H 1.762774 -2.176725 -1.307717
H 3.179181 -2.615866 -0.350606
H 2.349787 2.328829 1.084606
H 1.405586 1.381373 2.244257
H 2.820510 -0.270951 -2.216865
H 4.318303 -1.037621 -1.702082
H 0.173200 -3.180193 0.683954
H -2.287447 -3.155029 0.376368
H -1.828218 2.367127 -0.291026
H -4.366881 -1.927270 -0.038712
H -4.289256 2.340922 -0.597621
H -5.558690 0.218851 -0.473097


%chk=000181897-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000181897

0 1
O 3.735938 1.463499 -1.078434
O 0.105089 2.700055 0.399995
C 1.949237 -1.127248 0.795240
C 2.721356 0.212194 0.812169
C 2.683038 -1.945208 -0.330678
C 0.449476 -0.973910 0.523015
C 1.913790 1.409848 1.330619
C 3.027628 -0.898719 -1.414884
C 3.231360 0.405984 -0.636322
C -0.217844 0.272987 0.387884
C 0.548686 1.538652 0.651470
C -0.292210 -2.193707 0.407325
C -1.646617 0.296836 0.067509
C -2.360437 -0.961243 -0.054635
C -1.654446 -2.192226 0.135480
C -2.404056 1.502856 -0.125040
C -3.761682 -0.975322 -0.353350
C -3.772261 1.458458 -0.418185
C -4.464438 0.216002 -0.535269
H 2.059773 -1.655967 1.762301
H 3.633295 0.095327 1.435647
H 2.074569 -2.777060 -0.720191
H 3.611575 -2.377293 0.088612
H 2.461877 2.352396 1.162994
H 1.742164 1.304617 2.421206
H 2.176890 -0.745885 -2.108929
H 3.910230 -1.139527 -2.031032
H 0.233480 -3.145540 0.545944
H -2.206509 -3.136724 0.058845
H -1.886363 2.459719 -0.050469
H -4.270667 -1.943071 -0.436768
H -4.319225 2.396938 -0.562428
H -5.535194 0.202286 -0.765640


