%mem=6400mb
%nproc=4
#p b3lyp/genecp 5d 7f empiricaldispersion=gd3
scf=(maxcyc=1000,conver=8,nosym) scrf=pcm

of-water-complexes

2 1
                6           0       -0.674766    0.257857   -0.000088
                6           0       -1.685547    1.212867   -0.000005
                6           0       -2.035327   -0.165612   -0.000205
                7           0       -2.925972   -1.099996    0.000049
                6           0       -1.189816    3.575175    0.000071
                1           0       -0.590870    3.528003   -0.911105
                1           0       -1.863451    4.429163   -0.000882
                1           0       -0.592345    3.528894    0.912263
                6           0       -4.375412   -0.774252    0.000029
               1           0       -4.826256   -1.217025    0.893691
               1           0       -4.515204    0.307244    0.000049
               1           0       -4.826254   -1.216988   -0.893657
               8           0       -2.119107    2.393254   -0.000023
               6           0       -2.549288   -2.531515    0.000092
               1           0       -1.463567   -2.635243    0.000555
               1           0       -2.973765   -3.001727    0.892828
               1           0       -2.972986   -3.001597   -0.893090
              76           0        1.265836   -0.186777   -0.000018
               8           0        2.052441    1.317346   -0.000038
               8           0        1.530990   -1.122462   -1.399190
               8           0        1.531162   -1.122238    1.399381

-H -C -N -O -P -B -S -Al -Cl -F -He -Si 0
6-31+g*
****
-Pd -Os -Au -W -Fe -K -Ti -Cu -Co -Pt -Ag -Cr -V -Sc -Mn -Hf -Ir -I -Br -Ta -Zn -Zr -Mo -Re -Ru -Rh -Ru -Ni -Nb -Xe -Sn -In -Y -Ga -Hg 0
sdd
*******************

-Pd -Os -Au -W -Fe -K -Ti -Cu -Co -Pt -Ag -Cr -V -Sc -Mn -Hf -Ir -I -Br -Ta -Zn -Zr -Mo -Re -Ru -Rh -Ru -Ni -Nb -Xe -Sn -In -Y -Ga -Hg 0
sdd

