%chk=000271469.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271469

0 1
O 2.802325 -0.165002 -1.261603
O 2.391241 -1.028827 0.819483
O -2.865552 1.697027 0.617903
O -2.837580 -2.188075 0.745778
O -2.371112 0.646988 -1.327798
O -0.816343 -2.321938 -0.261642
C 2.180498 0.151687 0.006361
C 0.678405 0.374220 -0.229939
C 2.954155 1.286401 0.671875
C -0.122889 0.233261 1.064102
C 2.855019 -1.604841 -1.422942
C 2.452657 -2.181179 -0.056314
C 3.038758 2.528215 -0.222543
C -1.573720 -0.232500 0.839741
C 3.884517 3.624799 0.417903
C -2.284185 0.696333 -0.127674
C -1.628329 -1.667456 0.341275
C -3.580355 2.727039 -0.118601
C -3.130908 -3.555537 0.349512
H 0.515543 1.359776 -0.704787
H 0.329980 -0.366573 -0.986579
H 2.489012 1.528819 1.645974
H 3.975793 0.920069 0.910397
H -0.135285 1.194969 1.615591
H 0.386594 -0.501093 1.733153
H 2.157185 -1.862326 -2.235664
H 3.894122 -1.818679 -1.717996
H 3.201288 -2.841352 0.404664
H 1.450681 -2.651373 -0.059421
H 3.469530 2.238723 -1.205331
H 2.022817 2.912870 -0.438264
H -2.116488 -0.187870 1.831029
H 3.473185 3.945552 1.381353
H 3.938542 4.508491 -0.228234
H 4.912820 3.288404 0.596081
H -4.020453 3.329330 0.683430
H -4.345124 2.267598 -0.753479
H -2.868928 3.301033 -0.720033
H -4.090424 -3.744585 0.843063
H -2.343627 -4.224048 0.711301
H -3.215465 -3.604550 -0.740924


%chk=000271469-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000271469

0 1
O 2.874861 -0.104501 -1.438738
O 2.709058 -1.140343 0.668285
O -2.434320 1.887853 0.602338
O -3.112340 -2.050343 0.839942
O -2.533264 0.366363 -1.159749
O -0.928344 -2.580780 0.244019
C 2.271802 0.053926 -0.083050
C 0.733881 0.071698 -0.239983
C 2.899107 1.273650 0.602097
C 0.000633 0.058616 1.118676
C 3.210278 -1.540362 -1.620211
C 2.720556 -2.238016 -0.323628
C 2.603088 2.617380 -0.100575
C -1.514820 -0.282383 1.020094
C 3.381856 3.785049 0.541843
C -2.221991 0.637396 0.019467
C -1.768753 -1.745840 0.644534
C -3.050511 2.909577 -0.281679
C -3.530417 -3.419763 0.450627
H 0.455262 0.958098 -0.838731
H 0.437858 -0.812818 -0.829005
H 2.552613 1.306607 1.653448
H 3.990388 1.097764 0.627653
H 0.091810 1.040186 1.619125
H 0.479707 -0.697180 1.768136
H 2.701230 -1.920163 -2.524199
H 4.305163 -1.618057 -1.748024
H 3.416827 -3.002049 0.055244
H 1.707544 -2.669329 -0.430858
H 2.871865 2.527096 -1.170010
H 1.517104 2.836726 -0.059935
H -1.983439 -0.107768 2.006114
H 3.124615 3.896462 1.612566
H 3.158649 4.743814 0.038733
H 4.472825 3.614791 0.476062
H -3.081120 3.823806 0.326839
H -4.064742 2.592195 -0.575977
H -2.437503 3.050593 -1.187523
H -4.604650 -3.459148 0.676957
H -2.970674 -4.169986 1.033877
H -3.343792 -3.577015 -0.624597


