%chk=tbhp-Hp_to_H_Rud-TS.chk
%nprocshared=48
%mem=100GB
#p opt=(calcfc,ts,modredundant,noeigentest) freq wb97xd/gen scrf=(smd,solvent=dichloromethane) pseudo=read

tbhp-Hp_to_H_Rud-TS. From the converged H_R_uu-scan-Pd-OH-new-ts

1 1
 C                 -3.08142400    2.01821300    0.35850000
 C                 -1.82143700    1.94649500   -0.23230300
 C                 -1.20797400    3.09850100   -0.72099400
 C                 -1.90676000    4.28847300   -0.56701600
 C                 -3.17129600    4.33608100    0.04556100
 C                 -3.79653300    3.19013900    0.52392000
 C                 -2.43873500   -0.03377600    0.35172100
 H                 -0.23974100    3.06759200   -1.20381300
 H                 -1.46527000    5.20914400   -0.93289700
 H                 -3.67488300    5.29149600    0.14491500
 H                 -4.77369800    3.20847200    0.99138900
 C                 -2.45430900   -1.47996900    0.54553600
 C                 -3.50165200   -2.17357000    1.12953500
 N                 -1.33385600   -2.07760000    0.08793300
 C                 -3.37888400   -3.55712200    1.24608100
 H                 -4.38300100   -1.65127400    1.48304400
 C                 -1.22482900   -3.40058500    0.20410000
 C                 -2.22855900   -4.17800500    0.77937100
 H                 -4.17598500   -4.13695500    1.69765500
 H                 -0.31127900   -3.84583500   -0.17447500
 H                 -2.09712400   -5.25073200    0.85546300
 N                 -1.44213800    0.60223000   -0.20604400
 O                 -3.45507200    0.74412100    0.72084200
 Pd                 0.11693900   -0.62501400   -0.70986600
 O                  1.71094800   -1.82077700   -2.17479000
 O                  2.44298100   -1.39940500   -0.98884200
 C                  1.41256100    0.76483400   -1.32179900
 H                  1.17913600    1.01585400   -2.36100400
 H                  1.37547000    1.65861100   -0.69727400
 C                  2.74370900    0.02422800   -1.18038500
 C                  3.54998200    0.36926200    0.04615200
 C                  2.93605400    0.47769100    1.29898600
 C                  4.92924800    0.55699300   -0.05886800
 C                  3.69232300    0.77240500    2.42835900
 H                  1.86160600    0.33282200    1.38773100
 C                  5.68533000    0.86212000    1.07073200
 H                  5.41101500    0.46706500   -1.02847400
 C                  5.06831600    0.96862300    2.31449400
 H                  3.20847400    0.85590300    3.39649900
 H                  6.75579500    1.01558500    0.97734300
 H                  5.65675100    1.20630700    3.19544600
 H                  3.36426400    0.10143500   -2.07777300
 C                  2.04740437   -3.21010010   -2.21324052
 C                  2.24761563   -3.69050948   -0.79143737
 C                  0.90795481   -3.95747133   -2.87305958
 C                  3.32272968   -3.36856155   -3.01371272
 H                  3.07189576   -3.11933007   -0.30074996
 H                  1.31289727   -3.54780909   -0.19781716
 H                  2.51262294   -4.77516834   -0.77791971
 H                  0.74711376   -3.58217961   -3.91217496
 H                  1.13282694   -5.05012144   -2.92285764
 H                 -0.03603832   -3.81714976   -2.29370398
 H                  3.62083928   -4.44338416   -3.06711956
 H                  3.17816048   -2.98985686   -4.05397154
 H                  4.15390003   -2.79467364   -2.53801763

B 24 25 B

Pd 0 
sdd
F 1 1.0
1.472 1.0
****
C H 0
6-31g(d,p)
****
O N 0
6-31+g(d,p)
****

Pd
sdd