%nprocs=48
%mem=350GB
%chk=3t-tbujohnphos-6cn02-ts-rxt-c1.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt=(calcfc,ts,noeigentest) empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd        -0.88691        0.36592        0.71481
O         -1.96024       -0.69110        2.20524
O         -2.07347       -3.10567        2.68384
H         -1.59225       -0.43473        3.07533
B         -1.42284       -2.11729        1.86120
O          0.01953       -2.18311        2.08509
O         -1.75124        2.12396        1.13677
H         -1.57195        2.21430        2.09666
C         -1.71542       -2.24650        0.24638
C         -2.72643       -1.55030       -0.43466
C         -1.00631       -3.26042       -0.48020
C         -1.31013       -3.57422       -1.79211
C         -2.32978       -2.85830       -2.49444
C         -3.05269       -1.82221       -1.79743
C         -4.06038       -1.09501       -2.49722
C         -4.34436       -1.35635       -3.82584
C         -3.62200       -2.37868       -4.52121
C         -2.63545       -3.11593       -3.85583
H         -0.20187       -3.79355        0.04991
H         -0.76160       -4.36730       -2.32528
H         -3.32225       -0.79118        0.09886
H         -2.08499       -3.90181       -4.39422
H         -4.60854       -0.30616       -1.95928
H         -5.11896       -0.78929       -4.36102
H          0.17353       -2.80683        2.81664
H         -3.03061       -3.11391        2.51618
P          0.38445        1.47376       -0.78206
C          1.65478        2.61765       -0.05644
C          1.84059        2.87072        1.33235
C          1.11790        2.21118        2.45842
C          0.30928        3.00281        3.30663
C         -0.32385        2.43988        4.42436
H         -0.96439        3.06689        5.06297
C         -0.12721        1.08217        4.73598
H         -0.60547        0.64419        5.62541
C          0.68888        0.29398        3.91176
H          0.83928       -0.77210        4.12564
H          0.16373        4.06658        3.06568
C          1.29135        0.84795        2.76888
H          1.92646        0.21462        2.13557
C          2.78496        3.85197        1.72075
H          2.92096        4.03752        2.79674
C          3.54698        4.56468        0.79069
H          4.27564        5.31458        1.13356
C          3.37126        4.31116       -0.57593
H          3.95385        4.86018       -1.33064
C          2.43438        3.35473       -0.98122
H          2.29448        3.19179       -2.05593
C         -0.67865        2.56240       -1.96116
C         -0.08152        2.77996       -3.36136
H          0.05574        1.83763       -3.92453
H         -0.79315        3.40468       -3.94169
H          0.87935        3.32826       -3.34554
C         -2.03875        1.84765       -2.09789
H         -1.94829        0.84196       -2.54884
H         -2.69013        2.45454       -2.76191
H         -2.53642        1.74937       -1.11465
C         -0.88887        3.91922       -1.26077
H         -1.64987        4.49233       -1.83168
H          0.03879        4.52248       -1.23071
H         -1.25877        3.76255       -0.22848
C          1.38141        0.11892       -1.69764
C          2.54608        0.61065       -2.56877
H          3.33204        1.11330       -1.97398
H          3.01236       -0.27680       -3.04750
H          2.22389        1.28758       -3.38199
C          1.94993       -0.77391       -0.57495
H          2.66997       -0.21536        0.05714
H          2.49776       -1.62361       -1.03486
H          1.17164       -1.21045        0.08806
C          0.38855       -0.68586       -2.55066
H          0.88060       -1.61470       -2.90541
H          0.04868       -0.12739       -3.44331
H         -0.50046       -0.98765       -1.96884
C         -3.90993       -2.64100       -5.90080
N         -4.14677       -2.84712       -7.03287

