%chk=000251335.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000251335

0 1
O 1.120933 0.978835 -0.225796
O -2.176608 0.681243 -0.929366
C 2.339616 1.149679 -0.994551
C -0.032528 1.601603 -0.839993
C 3.416786 0.431990 -0.226170
C -1.189609 1.137422 0.044224
C 4.759217 0.776772 -0.444987
C 3.093369 -0.584224 0.682839
C -3.340904 0.115964 -0.457317
C 5.770172 0.101169 0.243372
C 4.109307 -1.252131 1.371822
C 5.447918 -0.912553 1.152102
C -3.669569 -0.056461 0.892028
C -4.207870 -0.285646 -1.495740
C -4.900798 -0.647880 1.201631
C -5.422841 -0.869440 -1.154770
C -5.774696 -1.052550 0.191958
H 2.546954 2.230903 -1.094483
H 2.197606 0.698547 -1.995793
H 0.102424 2.695695 -0.832361
H -0.157877 1.240495 -1.880024
H -1.634137 1.947097 0.643977
H -0.884548 0.290097 0.689031
H 5.017854 1.566563 -1.146479
H 2.045008 -0.839663 0.849504
H 6.811990 0.366642 0.072541
H 3.856156 -2.039305 2.080050
H 6.237847 -1.435130 1.687407
H -3.001589 0.250179 1.688229
H -3.912136 -0.134290 -2.530246
H -5.174230 -0.791335 2.247081
H -6.108295 -1.188137 -1.940181
H -6.727322 -1.510148 0.444262


%chk=000251335-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000251335

0 1
O 1.195480 0.404529 -0.309852
O -2.374393 0.510699 -1.094234
C 2.427627 0.845703 -0.966830
C 0.006925 0.698108 -1.112310
C 3.627023 0.446038 -0.124750
C -1.183887 0.219675 -0.283274
C 4.894514 1.016709 -0.404481
C 3.511141 -0.504150 0.917417
C -3.627212 0.157356 -0.564099
C 6.032388 0.637061 0.340937
C 4.649848 -0.880551 1.666840
C 5.913399 -0.315086 1.380747
C -3.815576 -0.459287 0.697742
C -4.740573 0.460615 -1.387584
C -5.128439 -0.770013 1.124867
C -6.040359 0.144885 -0.947050
C -6.243968 -0.473178 0.312320
H 2.406987 1.949366 -1.110054
H 2.494209 0.379253 -1.977216
H -0.078628 1.787160 -1.313613
H 0.040470 0.160862 -2.084095
H -1.224295 0.763075 0.681032
H -1.101995 -0.867285 -0.085320
H 4.993962 1.761643 -1.204934
H 2.527876 -0.929763 1.135876
H 7.006622 1.085508 0.115500
H 4.549498 -1.614599 2.474680
H 6.794608 -0.608242 1.962536
H -2.966303 -0.698065 1.344796
H -4.562706 0.937455 -2.356636
H -5.272580 -1.247149 2.100951
H -6.897837 0.380822 -1.587242
H -7.256228 -0.717153 0.651135


