%chk=000220513.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000220513

0 1
O -1.529134 0.003978 -2.704460
O -1.529067 0.001780 2.704490
C 1.083078 -0.000007 -1.313578
C 1.083111 -0.000737 1.313539
C -0.303614 0.000667 -0.675476
C -0.303596 0.000390 0.675473
C 1.793016 -1.212143 -0.712868
C 1.794568 1.210890 -0.712186
C 1.793000 -1.212562 0.712130
C 1.794620 1.210472 0.712808
C -1.546039 0.001233 -1.492575
C -1.546001 0.001443 1.492602
C 2.398006 -2.239382 -1.417010
C 2.400871 2.237749 -1.415756
C 2.397984 -2.240209 1.415681
C 2.400961 2.236923 1.416938
C -2.824505 0.001036 -0.705393
C -2.824486 0.000739 0.705454
C 3.012527 -3.282519 -0.697257
C 3.016782 3.279659 -0.695417
C 3.012516 -3.282925 0.695327
C 3.016827 3.279253 0.697168
C -4.037129 0.000774 -1.399264
C -4.037093 0.000078 1.399356
C -5.251334 0.000084 -0.697006
C -5.251315 -0.000265 0.697129
H 1.047055 0.000337 -2.420320
H 1.047119 -0.000984 2.420282
H 2.403047 -2.249035 -2.504834
H 2.405881 2.248027 -2.503574
H 2.403028 -2.250488 2.503499
H 2.406016 2.246580 2.504763
H 3.491046 -4.094806 -1.242343
H 3.496340 4.091642 -1.240047
H 3.491032 -4.095529 1.239946
H 3.496411 4.090923 1.242240
H -4.029048 0.000986 -2.494125
H -4.028982 0.000006 2.494218
H -6.193115 -0.000192 -1.246904
H -6.193084 -0.000768 1.247052


%chk=000220513-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000220513

0 1
O -1.529048 0.000647 -2.758828
O -1.528978 -0.000640 2.758856
C 1.085565 -0.000426 -1.311915
C 1.085598 -0.001163 1.311876
C -0.310654 -0.000076 -0.688432
C -0.310637 -0.000468 0.688428
C 1.800122 -1.227734 -0.710470
C 1.800996 1.226032 -0.709784
C 1.800141 -1.228132 0.709726
C 1.801013 1.225634 0.710413
C -1.556461 0.000577 -1.484897
C -1.556423 -0.000334 1.484925
C 2.415567 -2.268587 -1.425631
C 2.417194 2.266841 -1.424361
C 2.415605 -2.269385 1.424288
C 2.417228 2.266044 1.425557
C -2.843770 0.000867 -0.713975
C -2.843752 0.000471 0.714037
C 3.039624 -3.321692 -0.707671
C 3.042012 3.319093 -0.705813
C 3.039643 -3.322088 0.705723
C 3.042028 3.318698 0.707582
C -4.072387 0.001562 -1.414980
C -4.072351 0.000793 1.415073
C -5.294011 0.001900 -0.708213
C -5.293993 0.001515 0.708337
H 1.048014 -0.000117 -2.411297
H 1.048076 -0.001466 2.411258
H 2.412264 -2.269036 -2.521346
H 2.413900 2.267900 -2.520077
H 2.412331 -2.270446 2.520003
H 2.413960 2.266491 2.521273
H 3.521967 -4.140394 -1.253038
H 3.524953 4.137747 -1.250722
H 3.522001 -4.141093 1.250620
H 3.524981 4.137048 1.252936
H -4.044922 0.001826 -2.509297
H -4.044859 0.000448 2.509390
H -6.242634 0.002464 -1.255374
H -6.242603 0.001776 1.255522


