%nprocshared=20
%mem=44GB
%oldchk=Pd_reag.chk
%chk=Pd_r7_int_scan.chk
#p opt=(ts,noeigentest,calcfc) freq b3lyp/genecp empiricaldispersion=gd3bj

Pd_r7_int_scan_ts

1 1
 C                 -1.98280200    0.75745400   -0.29133400
 C                 -3.44629700    2.40594000    0.17561800
 C                 -2.62255800    2.85594600   -0.81116900
 N                 -1.72909400    1.82543200   -1.07564200
 N                 -3.03653700    1.11192600    0.47605200
 C                 -0.55477900    1.84863500   -1.96708800
 H                 -0.80165000    1.33001900   -2.89777900
 H                 -0.33927100    2.89349300   -2.20056500
 C                  0.61499100    1.19103500   -1.26415700
 C                  1.37619300    1.92084300   -0.36363700
 C                  0.84828400   -0.19529500   -1.43716700
 C                  2.40578500    1.28755400    0.35624900
 H                  1.16201500    2.97033200   -0.20276200
 C                  1.94299900   -0.81705800   -0.76807900
 H                  0.43518900   -0.72017900   -2.29657300
 C                  2.69698500   -0.08178400    0.15996300
 O                  3.71067000   -0.67225800    0.85689900
 O                  3.18959400    1.90901600    1.25566300
 O                  2.21430600   -2.07398300   -1.15784800
 C                  2.99966000    3.30281800    1.49828300
 H                  1.99776000    3.49893200    1.89698000
 H                  3.74764100    3.57339700    2.24290500
 H                  3.15980200    3.88756300    0.58542300
 C                  5.03584300   -0.34154300    0.40598100
 H                  5.23126400    0.72760100    0.52274600
 H                  5.71657900   -0.91131600    1.03969800
 H                  5.16872400   -0.63636200   -0.64168400
 C                  2.71421100   -3.05030200   -0.22946300
 H                  2.49418700   -4.01405000   -0.69095700
 H                  3.78781100   -2.94473000   -0.07306600
 H                  2.19372700   -2.96377000    0.72910700
 C                 -3.43230300    0.31147300    1.64111900
 H                 -2.61337500    0.36629400    2.36490100
 H                 -4.30842400    0.78439900    2.09041300
 C                 -3.74930400   -1.16171100    1.31569100
 H                 -3.76384300   -1.69041800    2.27532600
 H                 -4.76589000   -1.21568400    0.91169300
 C                 -2.84797400   -1.90161700    0.33247800
 H                 -3.28341100   -2.00901100   -0.65989900
 C                 -1.90696300   -2.90770700    0.68980000
 H                 -1.80238400   -3.78093000    0.05371800
 H                 -1.65924300   -3.06608200    1.73644500
 Pd                -0.97162000   -1.01487300   -0.13887200
 H                 -4.26699000    2.88772500    0.68368700
 H                 -2.60109100    3.79502200   -1.34172700
 H                 -0.30356200   -2.48986300    0.16095700

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

Pd
lanl2dz






























