%chk=000255052.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000255052

0 1
O 0.039509 -0.870213 1.453253
O -2.116737 1.684346 -0.364839
O 2.570570 -0.173640 -1.281656
O -3.485048 -0.910933 -2.414754
C 0.064216 0.762640 -0.297563
C 2.151145 0.127426 1.045526
C -2.013188 -0.703346 -0.563677
C 0.668085 -0.080737 0.788084
C -1.446678 0.679781 -0.409525
C 3.038486 -0.069750 -0.166190
C -3.384965 -0.755583 -1.220868
C 4.507382 -0.145070 0.074186
C -4.565222 -0.692316 -0.307202
C 5.111461 0.305335 1.257873
C -5.525723 -1.712431 -0.376843
C 5.304623 -0.682492 -0.951424
C -4.732485 0.374118 0.584323
C 6.495929 0.211746 1.414857
C -6.639222 -1.675837 0.465824
C 6.688496 -0.779286 -0.789024
C -5.853925 0.410985 1.418147
C 7.284541 -0.332749 0.394192
C -6.802775 -0.614921 1.363748
H 0.532457 0.472386 -1.281036
H 0.362726 1.829735 -0.184534
H 2.465194 -0.572276 1.857612
H 2.310134 1.143759 1.467115
H -1.321442 -1.350851 -1.149623
H -2.033973 -1.181503 0.450079
H 4.513149 0.735768 2.060216
H -5.403923 -2.526268 -1.092676
H 4.829388 -1.020078 -1.878151
H -3.996521 1.184861 0.614078
H 6.963833 0.563323 2.333852
H -7.382871 -2.469394 0.418133
H 7.301413 -1.200125 -1.585881
H -5.987630 1.242349 2.108461
H 8.365064 -0.406656 0.522425
H -7.673373 -0.586202 2.017781


%chk=000255052-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000255052

0 1
O -0.371310 -0.463729 1.166118
O -2.194241 1.363482 -1.500839
O 2.620228 -1.117429 -1.068445
O -4.240404 -1.374580 -2.584410
C -0.013833 0.370498 -1.112918
C 1.849691 0.389009 0.708016
C -2.140924 -1.090926 -1.416988
C 0.409946 0.047728 0.320626
C -1.527723 0.311297 -1.346245
C 2.930773 -0.369580 -0.095700
C -3.672775 -1.108441 -1.484587
C 4.358998 -0.192621 0.318996
C -4.462807 -0.823813 -0.244548
C 4.749336 0.655235 1.392036
C -5.881591 -0.804239 -0.344511
C 5.357864 -0.903725 -0.403586
C -3.848773 -0.584931 1.015063
C 6.111500 0.789984 1.731972
C -6.673476 -0.549813 0.790758
C 6.716608 -0.769204 -0.061100
C -4.646559 -0.331677 2.151969
C 7.096942 0.078533 1.008003
C -6.056462 -0.313287 2.044327
H 0.524157 -0.359346 -1.753901
H 0.354059 1.376669 -1.387295
H 1.970373 0.172232 1.784853
H 2.016619 1.476851 0.567541
H -1.761671 -1.570122 -2.341136
H -1.756269 -1.678060 -0.562119
H 4.000854 1.212001 1.965402
H -6.331494 -0.989822 -1.325550
H 5.038896 -1.551907 -1.226300
H -2.758042 -0.590836 1.119692
H 6.406027 1.444782 2.558832
H -7.765623 -0.533606 0.705752
H 7.479361 -1.320220 -0.621277
H -4.168846 -0.148114 3.120579
H 8.154173 0.183349 1.275395
H -6.671481 -0.115722 2.929827


