%mem=3200mb
%nproc=4
#p B3LYP/genecp scf=(xqc,nosym,maxcyc=1000,conver=8)
5D 7F empiricaldispersion=gd3 scrf=(pcm)

h2_eta1_pdhph32-loose-3_aq

1 1
 H	 0.021931000	 2.872597000	 0.033092000
 H	-0.015177000	 2.124357000	 0.036703000
 Pd	-0.000055000	 0.075523000	-0.010639000
 P	 2.332705000	-0.182855000	 0.009160000
 P	-2.332930000	-0.182108000	 0.009083000
 H	-0.000407000	-1.446700000	 0.046313000
 H	 3.114976000	 0.988265000	 0.000919000
 H	 2.875570000	-0.866671000	 1.111258000
 H	 2.897791000	-0.897381000	-1.062285000
 H	-3.115470000	 0.988788000	-0.000621000
 H	-2.897646000	-0.898074000	-1.061563000
 H	-2.875644000	-0.864770000	 1.111924000

-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


