%nprocshared=20
%mem=40GB
%chk=Pd_int_SP.chk
#p b3lyp/genecp empiricaldispersion=gd3bj

Pd_int_SP

1 1
 C                  2.07651300   -0.81056300   -0.39661300
 C                  4.07773400   -1.53405200    0.37232300
 C                  3.23222000   -2.59783100    0.35096600
 N                  2.00500600   -2.12420400   -0.11216400
 N                  3.34864300   -0.43459000   -0.08193800
 C                  0.71942800   -2.85110900   -0.09187400
 H                  0.62013300   -3.44938500   -1.00133100
 H                  0.76175100   -3.53782200    0.76068300
 C                 -0.45330300   -1.89713500    0.03263700
 C                 -0.49890000   -0.93240900    1.09339100
 C                 -1.44468900   -1.91336200   -0.91253300
 C                 -1.61488700   -0.07005700    1.18297600
 H                  0.16990600   -1.04063500    1.94016000
 C                 -2.53976800   -1.00338700   -0.86340000
 H                 -1.41537900   -2.59665000   -1.75423300
 C                 -2.62698500   -0.07316900    0.17895000
 O                 -3.62729400    0.85642400    0.23798300
 O                 -1.83608700    0.78205400    2.20027200
 O                 -3.38141300   -1.14395100   -1.89800300
 C                 -0.85687700    0.91095800    3.22629100
 H                  0.09409400    1.25774000    2.80004100
 H                 -1.24980200    1.65838800    3.91464300
 H                 -0.70788100   -0.03651000    3.75653000
 C                 -4.65056200    0.61384400    1.21834700
 H                 -4.23612200    0.62726700    2.22901400
 H                 -5.37037100    1.42512500    1.10267900
 H                 -5.14353900   -0.34778800    1.02988500
 C                 -4.52705600   -0.30463300   -2.11199300
 H                 -4.92912300   -0.63565300   -3.06997200
 H                 -5.27501200   -0.45429400   -1.32950200
 H                 -4.24476200    0.74747800   -2.15987300
 C                  3.71729900    0.97347300    0.18375700
 H                  3.94540100    1.05716800    1.25012900
 H                  4.62827700    1.22090000   -0.37481900
 C                  2.63568800    1.98808000   -0.18854600
 C                  1.98048600    1.84300300   -1.45617300
 H                  2.38268400    1.10663800   -2.14596700
 H                  2.85700800    2.98966500    0.17659000
 C                  1.17314400    2.95213000   -2.06408600
 H                  0.37622600    2.55597900   -2.70161700
 H                  0.72884000    3.59913700   -1.30138200
 H                  1.81972800    3.56980900   -2.70408400
 Pd                 0.76659900    0.77049000   -0.08676400
 H                  5.11366800   -1.46589300    0.66731700
 H                  3.39621300   -3.63302500    0.60857700
 H                  1.30040200    2.13249100    0.80781900

C H O N
cc-pVTZ
****
@/home/eapaloo/electrocyreact/cc-pVTZ_Pd_Basis_set.gbs/N








