%chk=000257898.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000257898

0 1
O -2.557996 -1.651565 -2.031408
O -5.002831 1.839398 -0.141444
O -0.673325 -2.864512 0.263046
O 4.735789 1.887041 -0.533390
O 5.626202 0.398390 0.914061
C -1.742688 -0.745169 0.093693
C 0.777655 -0.996659 0.192489
C -0.573300 -1.658934 0.175969
C -2.703784 -0.814427 -0.938231
C -1.900975 0.239344 1.083163
C -3.783122 0.069288 -0.994676
C 1.015570 0.165836 -0.551901
C 1.806967 -1.580658 0.944717
C -3.906158 1.036513 0.017674
C -2.972583 1.127834 1.066649
C 3.306802 0.177039 0.226797
C 2.282941 0.753181 -0.538064
C 3.072130 -0.991690 0.968217
C 4.667347 0.772742 0.278451
C -2.843076 -3.057461 -1.794764
C -5.246456 2.872372 0.847374
C 6.018375 2.568635 -0.583298
H -1.162889 0.308986 1.887272
H -4.506156 0.014391 -1.806704
H 0.213996 0.608489 -1.147767
H 1.614469 -2.502215 1.500466
H -3.073281 1.871186 1.849555
H 2.482632 1.657789 -1.119079
H 3.883244 -1.434170 1.554033
H -2.250202 -3.447278 -0.956042
H -2.533651 -3.512507 -2.742960
H -3.915672 -3.176960 -1.622333
H -5.412535 2.424616 1.831299
H -6.167429 3.332457 0.463664
H -4.422836 3.591833 0.855415
H 6.781318 1.885665 -0.970638
H 6.286851 2.920181 0.417977
H 5.819659 3.396498 -1.271685


%chk=000257898-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000257898

0 1
O -2.763135 -1.994456 -1.895555
O -5.313235 1.613873 -0.058708
O -0.574358 -2.762218 -0.088133
O 5.000921 2.047797 -0.266455
O 5.854514 0.148555 0.778822
C -1.708600 -0.630378 -0.124030
C 0.871597 -0.848239 0.031739
C -0.487991 -1.493465 -0.073201
C -2.841422 -0.969388 -0.935872
C -1.814673 0.511833 0.713155
C -4.012954 -0.193138 -0.888916
C 1.137043 0.454799 -0.469715
C 1.935417 -1.606758 0.591555
C -4.097546 0.925959 -0.024686
C -2.990392 1.284250 0.787173
C 3.489306 0.236737 0.172085
C 2.437750 0.992690 -0.406256
C 3.230352 -1.068310 0.670346
C 4.882345 0.762523 0.273736
C -3.282785 -3.317518 -1.482618
C -5.456367 2.793779 0.801967
C 6.359221 2.635973 -0.209221
H -0.964812 0.781849 1.349197
H -4.854777 -0.434509 -1.543859
H 0.330935 1.032178 -0.933275
H 1.719069 -2.618586 0.948767
H -3.032385 2.141149 1.464760
H 2.652087 1.988978 -0.801966
H 4.058018 -1.635864 1.107706
H -2.638537 -3.733562 -0.689366
H -3.232455 -3.941962 -2.387305
H -4.332831 -3.234269 -1.138749
H -5.353945 2.524645 1.870677
H -6.472492 3.166149 0.608150
H -4.715600 3.573034 0.539139
H 7.071947 2.005171 -0.766589
H 6.695339 2.720179 0.837965
H 6.256436 3.626019 -0.674866


