%mem=10000mb
%nprocshared=8
#p opt freq b3lyp/genecp 5d 7f empiricaldispersion=gd3
scf=(xqc,maxcyc=1000,conver=8,nosym)

imcn2nme2-pdph3

0 1
 Pd                 0.65152900   -0.00000300    0.00000400
 P                 -1.54403000   -0.00002900   -0.00000900
 H                 -2.26961001    1.21967452    0.00141609
 H                 -2.27013902   -0.60832690   -1.05683550
 H                 -2.27015097   -0.61080162    1.05538067
 C                  2.70152900    0.00001990    0.00001614
 N                  3.55073460    0.21466343    1.04804937
 N                  3.55122824   -0.21472506   -1.04859500
 C                  3.08891948    0.46488106    2.41343792
 C                  4.89084851    0.11708706    0.68025105
 C                  4.89134974   -0.15892742   -0.67133213
 C                  3.07716666   -0.50656226   -2.40290149
 H                  2.08904250    0.89564060    2.35478076
 H                  3.05063220   -0.47281777    2.97706389
 H                  3.76582440    1.16079602    2.91535842
 C                  5.98042864    0.28802846    1.56683723
 C                  5.98544008   -0.34573324   -1.54951745
 H                  2.25009409    0.16599769   -2.63618462
 H                  3.88787324   -0.35651311   -3.11909738
 H                  2.72915298   -1.54195781   -2.45989227
 N                  6.85397747    0.43478394    2.32397926
 N                  6.86396852   -0.50419421   -2.29843697

-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



