%mem=3200MB
%nprocshared=4
#p opt freq b3lyp/genecp 5d 7f empiricaldispersion=gd3
scf=(xqc,maxcyc=1000,conver=8,nosym)

of-vacuum-ligands

0 1
 C                 -0.00018900   -1.33442700   -0.00002500
 N                 -1.06422000   -0.50646600   -0.09005400
 C                 -0.76591300    0.93278700    0.08719500
 C                  0.76617000    0.93258300   -0.08726900
 N                  1.06410000   -0.50671700    0.09024300
 H                 -1.06216500    1.27114700    1.08958500
 H                  1.06277000    1.27073200   -1.08960700
 H                 -1.27959900    1.54696900   -0.65832900
 H                  1.27971400    1.54677400    0.65834700
 C                  2.43475666   -1.02852229   -0.00935397
 H                  2.40335879   -2.08840089   -0.15278180
 H                  2.93120192   -0.57083124   -0.83939072
 H                  2.96739773   -0.80615203    0.89161493
 C                 -2.43513070   -1.02785487    0.00821858
 H                 -2.93189009   -0.57080740    0.83842200
 H                 -2.96715980   -0.80438337   -0.89283942
 H                 -2.40421555   -2.08788807    0.15060489

-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


