%chk=000245434.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245434

0 1
O -0.995765 0.320528 -0.969139
O -0.073724 1.197621 0.976127
O -0.186198 -2.949860 -0.447556
O 3.104962 -0.048203 0.382456
O -1.659363 -1.868726 0.892015
O 2.219788 1.711121 -0.737363
C -1.135298 1.426076 -0.013999
C -0.028400 -0.619168 -0.515903
C 0.783778 0.142247 0.560408
C -2.444722 1.293300 0.754496
C -0.854630 2.696969 -0.773615
C -0.762106 -1.824805 0.091913
C 2.063854 0.747863 -0.034625
C -3.655652 1.649105 -0.095733
C -0.730645 -4.233764 -0.035999
C 4.441093 0.333215 -0.045230
H 0.545202 -0.919162 -1.424592
H 1.012393 -0.437924 1.485589
H -2.397101 1.925008 1.664933
H -2.534316 0.243174 1.125600
H 0.220538 2.774990 -1.023900
H -1.407757 2.725054 -1.721963
H -1.118746 3.587249 -0.191383
H -4.586591 1.440193 0.445681
H -3.667235 2.708381 -0.375699
H -3.676946 1.057320 -1.021342
H -1.731697 -4.347810 -0.463653
H -0.763627 -4.295323 1.056490
H -0.017069 -4.944219 -0.467147
H 4.470573 0.432902 -1.134887
H 5.051958 -0.504507 0.308313
H 4.716349 1.274855 0.440206


%chk=000245434-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245434

0 1
O -1.010365 0.437830 -1.031284
O -0.115782 1.168689 1.044782
O -0.040530 -2.964241 -0.416003
O 3.124661 -0.172089 0.392133
O -1.829367 -1.892498 0.626962
O 2.243488 1.685854 -0.707344
C -1.165326 1.492973 0.023675
C -0.077771 -0.583190 -0.585226
C 0.758309 0.117527 0.548074
C -2.522998 1.366378 0.733223
C -0.881977 2.841814 -0.635502
C -0.781122 -1.840365 -0.048711
C 2.083449 0.667602 -0.002622
C -3.728208 1.660049 -0.184466
C -0.559088 -4.266997 0.074275
C 4.476244 0.200334 -0.098800
H 0.547193 -0.875827 -1.444591
H 0.985042 -0.563879 1.383851
H -2.511848 2.062389 1.593974
H -2.592920 0.339673 1.131963
H 0.161517 2.874381 -0.985408
H -1.556910 2.987740 -1.495447
H -1.049430 3.657587 0.089111
H -4.671597 1.463400 0.355508
H -3.748697 2.711673 -0.523101
H -3.704338 1.008254 -1.075822
H -1.565626 -4.449437 -0.337144
H -0.610775 -4.266283 1.175921
H 0.162003 -5.010861 -0.290744
H 4.486219 0.231629 -1.201120
H 5.140027 -0.586520 0.284356
H 4.759425 1.190112 0.296024


