%nprocshared=20
%mem=40GB
%chk=Pd_int.chk
#p opt=qst2 freq b3lyp/genecp empiricaldispersion=gd3bj

Pd_int

1 1
 C                 -2.14383200   -0.65599800   -0.17021200
 C                 -4.05477600   -1.84119000   -0.14879700
 C                 -3.14944400   -2.54318900   -0.87994300
 N                 -1.97691500   -1.80074300   -0.87912400
 N                 -3.41786200   -0.68292600    0.27602400
 C                 -0.74875400   -2.16363200   -1.61799900
 H                 -0.64984000   -3.24993800   -1.55843900
 H                 -0.89057900   -1.89091600   -2.66854400
 C                  0.47387100   -1.48571700   -1.04505300
 C                  0.87249700   -0.22222000   -1.55323800
 C                  1.17001700   -2.06422700    0.00205000
 C                  1.98253700    0.42946600   -0.97653000
 H                  0.41454900    0.16037300   -2.45768000
 C                  2.27493300   -1.41479300    0.59029000
 H                  0.87818600   -3.02469900    0.41273400
 C                  2.67906100   -0.14961900    0.11294800
 O                  3.66748900    0.54811800    0.74295300
 O                  2.43602200    1.63924400   -1.37799300
 O                  2.81247400   -2.08219200    1.62585600
 C                  1.76468400    2.30342900   -2.44564500
 H                  0.71209500    2.48909400   -2.19296400
 H                  2.28325800    3.25315200   -2.57315900
 H                  1.82348700    1.72477300   -3.37436900
 C                  4.88411400    0.76378100    0.00574000
 H                  4.71095900    1.40796100   -0.85817500
 H                  5.56753100    1.24998900    0.70276400
 H                  5.30841000   -0.19329700   -0.31992300
 C                  4.12094700   -1.80203700    2.14547900
 H                  4.32100400   -2.62052500    2.83785500
 H                  4.86752900   -1.81179500    1.34546900
 H                  4.14631200   -0.84638300    2.66867800
 C                 -4.01836100    0.31276200    1.17932100
 H                 -5.09217600    0.32153400    0.97782300
 H                 -3.87029600   -0.03061400    2.20962500
 C                 -3.42646900    1.70818800    0.99318300
 C                 -1.94737100    1.77665500    1.31444300
 H                 -1.73985300    1.37042600    2.31242400
 H                 -3.61668800    2.06390900   -0.02600800
 C                 -1.25567400    3.10767400    1.08227700
 H                 -1.30321400    3.74806000    1.97392600
 H                 -0.16785900    2.97995800    0.89569700
 H                 -1.67879700    3.65188900    0.23310900
 Pd                -0.74267300    0.70882700    0.08352500
 H                 -5.07902800   -2.06070400    0.10915600
 H                 -3.23497100   -3.48527700   -1.39857000
 H                  0.56188407    1.60014556    0.07446546

r6

1 1
 C                 -2.14383200   -0.65599800   -0.17021200
 C                 -4.05477600   -1.84119000   -0.14879700
 C                 -3.14944400   -2.54318900   -0.87994300
 N                 -1.97691500   -1.80074300   -0.87912400
 N                 -3.41786200   -0.68292600    0.27602400
 C                 -0.74875400   -2.16363200   -1.61799900
 H                 -0.64984000   -3.24993800   -1.55843900
 H                 -0.89057900   -1.89091600   -2.66854400
 C                  0.47387100   -1.48571700   -1.04505300
 C                  0.87249700   -0.22222000   -1.55323800
 C                  1.17001700   -2.06422700    0.00205000
 C                  1.98253700    0.42946600   -0.97653000
 H                  0.41454900    0.16037300   -2.45768000
 C                  2.27493300   -1.41479300    0.59029000
 H                  0.87818600   -3.02469900    0.41273400
 C                  2.67906100   -0.14961900    0.11294800
 O                  3.66748900    0.54811800    0.74295300
 O                  2.43602200    1.63924400   -1.37799300
 O                  2.81247400   -2.08219200    1.62585600
 C                  1.76468400    2.30342900   -2.44564500
 H                  0.71209500    2.48909400   -2.19296400
 H                  2.28325800    3.25315200   -2.57315900
 H                  1.82348700    1.72477300   -3.37436900
 C                  4.88411400    0.76378100    0.00574000
 H                  4.71095900    1.40796100   -0.85817500
 H                  5.56753100    1.24998900    0.70276400
 H                  5.30841000   -0.19329700   -0.31992300
 C                  4.12094700   -1.80203700    2.14547900
 H                  4.32100400   -2.62052500    2.83785500
 H                  4.86752900   -1.81179500    1.34546900
 H                  4.14631200   -0.84638300    2.66867800
 C                 -4.01836100    0.31276200    1.17932100
 H                 -5.09217600    0.32153400    0.97782300
 H                 -3.87029600   -0.03061400    2.20962500
 C                 -3.42646900    1.70818800    0.99318300
 C                 -1.94737100    1.77665500    1.31444300
 H                 -1.73985300    1.37042600    2.31242400
 H                 -3.61668800    2.06390900   -0.02600800
 C                 -1.25567400    3.10767400    1.08227700
 H                 -1.30321400    3.74806000    1.97392600
 H                 -0.16785900    2.97995800    0.89569700
 H                 -1.67879700    3.65188900    0.23310900
 Pd                -0.74267300    0.70882700    0.08352500
 H                 -5.07902800   -2.06070400    0.10915600
 H                 -3.23497100   -3.48527700   -1.39857000
 H                 -3.97939300    2.37530800    1.67171200

C H O N 
6-31G(d)
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Pd
lanl2dz
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Pd
lanl2dz
























