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

of-water-

0 1
 C                  0.00000100   -1.57354200    0.00006600
 N                 -1.06179500   -0.71236900    0.00007300
 C                 -0.68217300    0.63619900    0.00020200
 C                  0.68217800    0.63619900   -0.00013200
 N                  1.06179200   -0.71237400   -0.00016200
 C                 -2.44287700   -1.16341000   -0.00030500
 H                 -2.97234400   -0.80415800    0.89023900
 H                 -2.97149700   -0.80543300   -0.89187700
 H                 -2.43364500   -2.25418700    0.00047400
 C                  2.44287600   -1.16341200    0.00018600
 H                  2.97249600   -0.80365400   -0.89005900
 H                  2.97133500   -0.80593400    0.89205700
 H                  2.43365200   -2.25418900   -0.00120000
 C                 -1.66813300    1.75834100    0.00022100
 H                 -2.31923900    1.73045200   -0.88396600
 H                 -2.31992100    1.72983100    0.88387900
 H                 -1.15314300    2.72392900    0.00078000
 C                  1.66813400    1.75834400   -0.00012600
 H                  2.31933400    1.73034900    0.88398900
 H                  2.31982900    1.72995200   -0.88385600
 H                  1.15313400    2.72392600   -0.00051100

-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

