%chk=000257408.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257408

0 1
O 4.886218 -0.299256 -1.087317
O -1.493247 0.921043 -2.327057
O -6.168093 -0.296346 0.301852
C -0.454279 -0.462875 0.150753
C 0.257563 0.913738 -0.002047
C 1.721170 0.726966 0.423006
C -1.968412 -0.372981 -0.214255
C 2.441961 -0.279933 -0.529285
C -2.614376 0.740879 0.667235
C 0.273892 -1.553778 -0.666916
C 1.775414 -1.652661 -0.342903
C -0.437243 2.000441 0.834093
C 3.929601 -0.135820 -0.023672
C 2.653058 1.951393 0.447141
C -1.926261 2.103049 0.486652
C -2.662520 -1.713169 0.171905
C 4.075112 1.354552 0.399849
C -4.127268 0.844902 0.423941
C -2.210302 -0.166507 -1.731136
C 2.394983 0.136607 -2.004664
C -4.183889 -1.675863 -0.001937
C -4.808049 -0.489676 0.750387
C 4.274135 -1.061436 1.048759
C 4.581274 -1.820377 1.932207
H -0.392337 -0.752596 1.229937
H 0.223974 1.209774 -1.084547
H 1.723885 0.291069 1.455686
H -2.464099 0.436843 1.737017
H 0.149167 -1.346901 -1.749977
H -0.199868 -2.536217 -0.484863
H 1.914529 -2.015515 0.693208
H 2.249569 -2.409116 -0.993218
H 0.056204 2.975791 0.662168
H -0.315454 1.789780 1.913824
H 2.500944 2.565231 1.347908
H 2.471262 2.610647 -0.418822
H -2.412877 2.863285 1.126459
H -2.052694 2.468508 -0.556943
H -2.416602 -1.961513 1.222790
H -2.244247 -2.542178 -0.431360
H 4.714575 1.875102 -0.338408
H 4.588069 1.445796 1.370286
H -4.574577 1.648015 1.039974
H -4.354377 1.127746 -0.623643
H -3.286489 -0.014145 -1.943059
H -1.845168 -1.032059 -2.317030
H 2.736881 -0.666710 -2.663302
H 1.373337 0.407599 -2.311804
H 3.037543 1.004109 -2.201504
H -4.452121 -1.604309 -1.075572
H -4.624138 -2.627142 0.349030
H -4.834143 -0.677431 1.845954
H 4.842213 -1.202191 -1.459332
H -1.689817 1.762845 -1.840343
H -6.706795 -1.089058 0.466989
H 4.846308 -2.470150 2.690204


%chk=000257408-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257408

0 1
O 5.049126 -0.572535 -0.873938
O -1.578343 0.895116 -2.539868
O -6.253529 -0.374655 0.708502
C -0.451789 -0.438398 -0.028613
C 0.276692 0.950046 -0.077467
C 1.747102 0.733216 0.334704
C -2.000397 -0.359004 -0.308642
C 2.505287 -0.260105 -0.599677
C -2.617165 0.735666 0.638676
C 0.286993 -1.482830 -0.914950
C 1.788684 -1.629656 -0.548347
C -0.418847 1.992267 0.829179
C 3.952199 -0.186184 0.046890
C 2.696800 1.958477 0.428361
C -1.928721 2.115320 0.532567
C -2.674683 -1.715275 0.101973
C 4.132914 1.344774 0.344107
C -4.159278 0.816966 0.536454
C -2.320020 -0.160605 -1.823822
C 2.600910 0.238176 -2.065784
C -4.225133 -1.683076 0.058249
C -4.798447 -0.528646 0.905355
C 4.062467 -0.996413 1.281760
C 4.205626 -1.684970 2.295322
H -0.362321 -0.789583 1.028845
H 0.239789 1.321810 -1.118645
H 1.728314 0.260104 1.344051
H -2.389430 0.376768 1.670943
H 0.192637 -1.194466 -1.978508
H -0.193269 -2.474732 -0.810344
H 1.874049 -2.051300 0.472902
H 2.266194 -2.352548 -1.241690
H 0.075709 2.976325 0.714683
H -0.290197 1.694487 1.892794
H 2.544129 2.525724 1.362889
H 2.515081 2.656230 -0.411134
H -2.400396 2.809646 1.256629
H -2.091126 2.573573 -0.466468
H -2.346776 -1.961841 1.133532
H -2.318283 -2.538299 -0.546040
H 4.720944 1.770841 -0.487002
H 4.709875 1.499062 1.270386
H -4.541594 1.596493 1.222719
H -4.491279 1.103054 -0.480581
H -3.406631 -0.007445 -1.972511
H -2.039455 -1.078992 -2.366964
H 3.175313 -0.481487 -2.674540
H 1.600936 0.349915 -2.516219
H 3.119407 1.208274 -2.145499
H -4.590407 -1.567379 -0.980253
H -4.619839 -2.652492 0.427441
H -4.587179 -0.739613 1.979945
H 5.076415 -1.562473 -0.934586
H -1.908355 1.780767 -2.248718
H -6.697900 -1.234931 0.921095
H 4.330298 -2.275358 3.184155


