%chk=000245568.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000245568

0 1
O -0.509830 0.353288 0.163111
O 0.465163 -1.432757 -0.820945
O 4.302452 0.354744 1.576387
C -1.858172 -0.118395 -0.222459
C -2.321530 -1.112879 0.844390
C -2.673565 1.176758 -0.240189
C -3.815675 -1.412162 0.674487
C -4.164605 0.857487 -0.402857
C -4.648552 -0.122350 0.675613
C 0.574121 -0.407791 -0.186281
C 1.817613 0.246418 0.347640
C 3.060637 -0.259881 -0.378333
C 4.323049 -0.014299 0.424540
C 5.606475 -0.270203 -0.312071
H -1.778769 -0.589783 -1.224879
H -2.122150 -0.699119 1.852304
H -1.727540 -2.045059 0.773885
H -2.322027 1.838477 -1.053214
H -2.496442 1.738248 0.699548
H -4.155784 -2.082557 1.486347
H -3.982334 -1.967993 -0.268915
H -4.351255 0.432366 -1.408231
H -4.752341 1.793685 -0.353616
H -5.715817 -0.362970 0.514115
H -4.589796 0.359097 1.671039
H 1.898900 0.043448 1.445090
H 1.735917 1.353359 0.285496
H 3.139972 0.201837 -1.383138
H 2.962979 -1.353804 -0.580205
H 6.465731 -0.258207 0.376917
H 5.796395 0.503013 -1.068691
H 5.612781 -1.238817 -0.826687


%chk=000245568-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000245568

0 1
O -0.487234 0.434927 0.297109
O 0.488211 -1.430603 -0.715964
O 4.459538 -0.084042 1.629264
C -1.861419 -0.058201 -0.072289
C -2.387001 -0.993721 1.030235
C -2.735766 1.190550 -0.244923
C -3.850635 -1.404770 0.727511
C -4.199307 0.780217 -0.548230
C -4.757867 -0.163884 0.543878
C 0.596713 -0.359493 -0.069121
C 1.896355 0.240999 0.437031
C 3.105702 -0.203814 -0.401768
C 4.425288 -0.174159 0.372667
C 5.697964 -0.271932 -0.459188
H -1.768350 -0.617165 -1.024068
H -2.340603 -0.460323 2.000371
H -1.739644 -1.886461 1.103944
H -2.329220 1.825018 -1.054164
H -2.699111 1.783940 0.689795
H -4.231654 -2.046241 1.544479
H -3.875979 -2.017691 -0.197054
H -4.243348 0.267865 -1.531553
H -4.828153 1.686622 -0.633221
H -5.786846 -0.479128 0.284887
H -4.821777 0.387228 1.504814
H 2.053753 -0.093711 1.482625
H 1.800561 1.338541 0.483498
H 3.208259 0.395024 -1.327340
H 2.940294 -1.247564 -0.745357
H 6.553132 -0.546624 0.177652
H 5.907944 0.712233 -0.922809
H 5.586199 -1.000441 -1.282512


