%chk=000256022.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000256022

0 1
O -2.448082 -0.476912 -1.553749
O 0.399964 0.007386 -0.095898
O -1.814029 2.440202 0.408101
O -2.747528 -1.318665 0.589774
O -4.217197 2.596826 -0.794237
O 0.915429 -0.230392 2.096922
C -1.461424 1.460424 -0.558209
C -0.995405 0.210785 0.231379
C -2.645213 0.953325 -1.432133
C -1.767782 -0.978593 -0.385157
C -4.024824 1.163404 -0.791380
C 1.296956 -0.182348 0.953647
C -3.551414 -2.471298 0.256074
C 2.670596 -0.315410 0.419183
C 3.715419 -0.518198 1.336688
C 2.938887 -0.240695 -0.955894
C 5.025949 -0.647336 0.873259
C 4.252974 -0.371218 -1.411197
C 5.294037 -0.574018 -0.498529
H -0.634591 1.880939 -1.173278
H -1.143877 0.319182 1.334114
H -2.610046 1.327442 -2.475374
H -1.181411 -1.842190 -0.738222
H -4.051900 0.775159 0.245850
H -4.820625 0.692275 -1.393689
H -2.590420 2.988505 0.095906
H -5.010649 2.825795 -0.268261
H -2.930675 -3.371750 0.253426
H -4.044517 -2.320095 -0.709540
H -4.279345 -2.500167 1.075559
H 3.493105 -0.572074 2.406205
H 2.118249 -0.080319 -1.660141
H 5.839269 -0.804122 1.580845
H 4.466193 -0.313732 -2.477795
H 6.318825 -0.674716 -0.857247


%chk=000256022-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000256022

0 1
O -2.227076 -0.604946 -1.350423
O 0.435708 0.314174 -0.015261
O -2.359310 2.404191 0.560662
O -2.823066 -1.044615 0.961241
O -4.228743 2.544994 -1.392722
O 0.892915 -1.054966 1.817687
C -1.622786 1.557526 -0.371071
C -0.979745 0.403608 0.430090
C -2.521809 0.848299 -1.448417
C -1.741860 -0.870506 0.014339
C -4.025825 1.079603 -1.230409
C 1.293333 -0.448143 0.793858
C -3.541324 -2.316060 0.783185
C 2.694834 -0.436662 0.287244
C 3.670445 -1.163558 1.018744
C 3.068531 0.268300 -0.886648
C 5.009627 -1.184753 0.579814
C 4.410206 0.243321 -1.321891
C 5.381832 -0.481550 -0.591200
H -0.824298 2.138611 -0.872122
H -1.028828 0.569171 1.516935
H -2.244803 1.145743 -2.473538
H -1.119772 -1.781441 -0.057320
H -4.314322 0.752602 -0.214642
H -4.597128 0.523245 -1.996425
H -3.060100 2.887966 0.033018
H -5.193584 2.758454 -1.380545
H -2.854741 -3.175206 0.923370
H -4.005863 -2.375843 -0.219314
H -4.317594 -2.333072 1.563018
H 3.357638 -1.698483 1.921630
H 2.307864 0.823626 -1.441859
H 5.761552 -1.745069 1.145677
H 4.699810 0.786941 -2.227641
H 6.423179 -0.498103 -0.932065


