%chk=000228644.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000228644

0 1
O 1.340064 0.607120 0.281432
O 2.517216 -1.392562 0.628553
C -0.922937 -1.809715 -0.393718
C 0.158269 -1.407764 0.626593
C 1.386608 -0.795813 -0.032565
C -2.288476 -1.987074 0.303417
C 2.534252 1.351799 -0.085726
C 3.747018 0.711262 0.606990
C 3.782405 -0.786080 0.297914
C -0.530484 -3.100356 -1.123815
C -2.878603 -0.655266 0.796518
C 2.243428 2.765506 0.393958
C -3.263338 0.242855 -0.339878
C -2.695168 1.425255 -0.624915
C -3.164182 2.243259 -1.793024
C -1.575143 2.025678 0.163416
H -1.027139 -0.987267 -1.147214
H -0.256144 -0.671638 1.353535
H 0.470871 -2.276979 1.242348
H 1.488813 -0.924661 -1.126278
H -2.191062 -2.685924 1.154898
H -2.997420 -2.466113 -0.399235
H 2.631758 1.303924 -1.193090
H 3.658334 0.853892 1.704108
H 4.685026 1.204994 0.303099
H 4.012268 -0.993679 -0.761341
H 4.484111 -1.336801 0.950192
H -0.486137 -3.955419 -0.440059
H -1.249102 -3.346400 -1.912555
H 0.455238 -3.014016 -1.592749
H -3.776937 -0.859279 1.415623
H -2.155721 -0.160963 1.478706
H 1.986434 2.773391 1.462669
H 3.098989 3.430550 0.243580
H 1.379339 3.188563 -0.134902
H -4.071208 -0.148713 -0.956582
H -3.563429 3.210194 -1.458989
H -3.954655 1.748168 -2.369916
H -2.337264 2.449382 -2.485323
H -1.340674 3.051444 -0.138022
H -1.798992 2.045740 1.237789
H -0.644723 1.434607 0.047156


%chk=000228644-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000228644

0 1
O 1.313081 0.336866 -0.223289
O 2.279382 -0.979267 1.565946
C -0.847900 -1.730907 -0.523947
C 0.114070 -1.575161 0.683178
C 1.486222 -1.010167 0.332868
C -2.291185 -2.048324 -0.044439
C 2.625937 0.946466 -0.571862
C 3.510939 0.990558 0.693601
C 3.622252 -0.422794 1.298988
C -0.361587 -2.827252 -1.502815
C -3.024026 -0.874104 0.673156
C 2.325377 2.318706 -1.172673
C -3.263766 0.311471 -0.240926
C -2.712391 1.557638 -0.161384
C -3.027329 2.617434 -1.206022
C -1.728999 1.994935 0.912747
H -0.874276 -0.763347 -1.062556
H -0.320535 -0.899060 1.441249
H 0.272013 -2.557385 1.170463
H 2.041950 -1.623674 -0.418641
H -2.267129 -2.928299 0.633121
H -2.895083 -2.348428 -0.925833
H 3.114372 0.290938 -1.331697
H 3.049671 1.673246 1.430812
H 4.518292 1.376904 0.441702
H 4.167525 -1.098260 0.600782
H 4.138070 -0.420793 2.272310
H -0.323031 -3.815712 -1.003552
H -1.047553 -2.912840 -2.366241
H 0.646537 -2.610777 -1.902403
H -4.000372 -1.258471 1.035348
H -2.457109 -0.572686 1.572596
H 1.809924 2.956282 -0.432467
H 3.261040 2.820973 -1.478790
H 1.672714 2.218201 -2.056930
H -3.944444 0.109534 -1.084474
H -3.509298 3.502688 -0.744526
H -3.697694 2.232905 -1.994829
H -2.098028 2.980461 -1.690261
H -1.910850 3.047068 1.204404
H -1.786396 1.375762 1.823909
H -0.688883 1.923776 0.535973


