%chk=000236677.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000236677

0 1
O -1.819477 0.543427 1.317168
O -1.879861 0.987467 -0.977872
O 6.235766 -0.305551 -0.391045
C -3.729626 -0.310581 0.009681
C -3.224072 0.230930 1.371155
C -3.289766 0.706880 -1.072712
C -1.412803 1.464418 0.293248
C -5.272610 -0.386982 0.055070
C -3.071346 -1.675146 -0.293164
C 0.118990 1.365430 0.234852
C -1.922433 2.874468 0.579381
C -5.909668 -0.851086 -1.251334
C -3.447761 -2.790905 0.675991
C 0.588716 -0.066104 -0.059505
C 2.087904 -0.142837 -0.105055
C 2.771172 0.093301 -1.314327
C 2.819066 -0.440623 1.050708
C 4.157902 0.029866 -1.371277
C 4.216902 -0.511293 1.021802
C 4.869314 -0.274871 -0.192027
C 7.074834 -0.614392 0.746056
H -3.775412 1.127326 1.698840
H -3.253754 -0.537244 2.166090
H -3.369998 0.300659 -2.096885
H -3.849144 1.654326 -1.006342
H -5.687461 0.602548 0.331783
H -5.573364 -1.074988 0.871577
H -1.968202 -1.523865 -0.278194
H -3.320032 -1.983374 -1.326857
H 0.540312 1.710786 1.199543
H 0.496561 2.055566 -0.545241
H -3.015125 2.922505 0.614567
H -1.550704 3.235896 1.545236
H -1.592566 3.574231 -0.197420
H -5.727921 -0.148521 -2.071683
H -5.522813 -1.829181 -1.564069
H -6.996247 -0.950725 -1.143315
H -4.519752 -3.014712 0.646714
H -2.912853 -3.715736 0.429045
H -3.186775 -2.534359 1.709966
H 0.141629 -0.407159 -1.018212
H 0.174561 -0.751306 0.711574
H 2.204500 0.328598 -2.215535
H 2.297269 -0.620961 1.990610
H 4.702736 0.207229 -2.294892
H 4.764466 -0.745133 1.927232
H 6.854410 -1.618140 1.120234
H 6.956946 0.145662 1.523498
H 8.078389 -0.571646 0.303543


%chk=000236677-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000236677

0 1
O -1.841657 0.511510 1.344225
O -1.894072 0.958476 -1.040002
O 6.416853 -0.198114 -0.374586
C -3.804964 -0.306101 -0.002581
C -3.293227 0.256458 1.353603
C -3.348287 0.710571 -1.087522
C -1.406197 1.430009 0.271657
C -5.361092 -0.340684 0.058017
C -3.175619 -1.698856 -0.307101
C 0.126906 1.323452 0.217115
C -1.871289 2.874520 0.553211
C -6.070390 -0.897907 -1.197216
C -3.560028 -2.839943 0.659615
C 0.646946 -0.112373 -0.056335
C 2.165574 -0.166202 -0.112203
C 2.865498 0.162253 -1.306154
C 2.933575 -0.513487 1.024482
C 4.270971 0.144526 -1.363507
C 4.348302 -0.537798 0.991082
C 5.018508 -0.206066 -0.211313
C 7.229556 -0.566062 0.784727
H -3.849224 1.185990 1.607138
H -3.440653 -0.463862 2.175399
H -3.518513 0.322580 -2.105589
H -3.909050 1.664954 -0.974669
H -5.728959 0.689779 0.247814
H -5.668573 -0.938342 0.939788
H -2.076951 -1.577267 -0.309918
H -3.455116 -1.990607 -1.339573
H 0.529368 1.687846 1.180832
H 0.487044 2.008470 -0.573101
H -2.969781 2.972494 0.583113
H -1.471718 3.206882 1.526566
H -1.490772 3.544195 -0.236978
H -5.831208 -0.311022 -2.102799
H -5.790612 -1.948576 -1.392095
H -7.167235 -0.865564 -1.063689
H -4.649224 -3.030654 0.669100
H -3.062580 -3.779106 0.355451
H -3.242920 -2.627262 1.696894
H 0.210535 -0.458131 -1.011202
H 0.263651 -0.774888 0.740299
H 2.296506 0.426912 -2.206279
H 2.418875 -0.776261 1.957272
H 4.810722 0.390110 -2.283536
H 4.904087 -0.817041 1.891598
H 7.011553 -1.599212 1.120611
H 7.073869 0.135486 1.628174
H 8.271811 -0.501985 0.438365


