%chk=000259216.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000259216

0 1
O -0.711118 0.515955 0.057426
O -0.190055 -1.640137 0.235878
O -1.966954 0.528567 -1.903339
O 1.959431 1.256582 -1.345994
O -1.005739 3.069379 0.563888
O 1.915440 3.391467 -0.077249
O -2.854258 1.271280 1.453765
O -5.140775 0.601354 -0.029062
O -3.386991 -2.136615 -2.456601
O 3.627273 -2.946690 2.760990
O 2.054478 -4.494209 2.402462
C 1.502463 0.170592 0.790564
C 2.504138 1.058369 -0.037125
C 2.399366 -0.928585 1.432906
C 0.411838 -0.356596 -0.138024
C 3.756912 0.209843 -0.142869
C 3.684744 -0.881645 0.624703
C -1.129074 1.302203 -1.078435
C 1.746340 -2.272463 1.502858
C 2.747424 2.447590 0.603513
C -1.871956 2.487412 -0.405675
C -3.173840 2.002482 0.270918
C -4.004723 1.127512 -0.698180
C -3.152694 -0.032488 -1.264863
C 0.526824 -2.516919 0.965684
C -3.856446 -0.790005 -2.397369
C 2.418491 -3.350543 2.226171
H 1.012040 0.768080 1.593907
H 2.649227 -0.619738 2.486798
H 0.678515 -0.477215 -1.210607
H 4.545378 0.503704 -0.815343
H 4.414567 -1.669803 0.744429
H -0.270226 1.575927 -1.729686
H -2.050983 3.304876 -1.141078
H 3.771474 2.821682 0.404532
H 2.564026 2.468153 1.688506
H -3.776768 2.852654 0.671414
H -4.447428 1.742987 -1.516678
H -2.811104 -0.732654 -0.467919
H -0.044449 -3.450820 1.041388
H 2.038584 2.221441 -1.615417
H -3.707001 -0.293569 -3.373841
H -4.940653 -0.907590 -2.181760
H -1.049033 2.525629 1.404260
H 0.957609 3.283977 0.199156
H -2.248950 0.498662 1.248850
H -4.887743 0.266254 0.870698
H -2.437495 -2.152839 -2.710690
H 4.074576 -3.685891 3.257238


%chk=000259216-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000259216

0 1
O -0.694060 0.504954 0.096073
O -0.213320 -1.722597 0.458975
O -2.011277 0.387558 -1.943574
O 2.049815 1.178668 -1.346088
O -0.962512 3.249474 0.278008
O 1.721702 3.421565 -0.158616
O -2.833553 1.552870 1.405268
O -5.189833 0.782138 0.073928
O -3.305062 -2.083216 -2.652898
O 3.827789 -3.204735 2.642202
O 2.222681 -4.784305 2.061062
C 1.545155 0.077546 0.902264
C 2.491152 1.046234 0.060405
C 2.480735 -1.029055 1.513256
C 0.402185 -0.445530 0.014721
C 3.825807 0.330244 0.081685
C 3.817405 -0.808732 0.812107
C -1.119230 1.187092 -1.139360
C 1.897387 -2.431969 1.461424
C 2.562979 2.517046 0.632535
C -1.818849 2.483360 -0.645177
C -3.142249 2.141416 0.074889
C -4.042602 1.182833 -0.738366
C -3.260373 -0.055015 -1.234252
C 0.624240 -2.667757 1.014461
C -4.030365 -0.873077 -2.271584
C 2.603606 -3.585282 2.045048
H 1.057668 0.639874 1.719063
H 2.630403 -0.800177 2.589739
H 0.714219 -0.583218 -1.033150
H 4.669868 0.726290 -0.490479
H 4.655983 -1.491118 0.965398
H -0.240916 1.381116 -1.774685
H -2.007660 3.128020 -1.519166
H 3.587383 2.908220 0.521708
H 2.290669 2.530885 1.704939
H -3.703880 3.059642 0.312541
H -4.461419 1.724589 -1.606569
H -2.962443 -0.707972 -0.390448
H 0.146274 -3.648954 1.085261
H 1.884516 2.171229 -1.453423
H -4.243372 -0.233677 -3.155645
H -4.982158 -1.211969 -1.833396
H -1.224189 2.958455 1.196394
H 0.737778 3.369949 0.085038
H -2.141981 0.836740 1.269327
H -4.854269 0.656231 1.003671
H -2.403280 -1.809499 -2.961788
H 4.246154 -4.018786 3.032371


