%nprocs=48
%mem=350GB
%chk=3n-tbuxphos-68-ts-t3ob-2h2o-t4ob.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt=(calcfc,ts,noeigentest) empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd        -0.12509        1.09453        0.65267
O          0.30857        2.63514       -0.73785
B          1.70190        2.70310       -0.37515
O          1.91542        1.87143        0.87169
O          2.70252        2.38389       -1.33056
O         -0.06733       -0.09162        2.25620
H          0.68379       -0.67283        2.01471
O          1.95059        4.21656        0.15990
H          0.94754        4.51637        0.55945
H          2.58955        4.15141        0.89498
H          2.53216        1.14464        0.64993
H          2.37974        2.59322       -2.22239
O         -0.39135        4.49312        0.69990
H         -0.57147        4.00967        1.53042
H         -0.26420        3.65142       -0.02808
P         -2.24204        0.39248        0.28152
C         -3.23680        0.36808        1.94514
C         -2.95036       -0.97873        2.63432
H         -1.85696       -1.13924        2.69296
H         -3.36389       -0.94325        3.66478
H         -3.42817       -1.82653        2.10617
C         -4.75804        0.55719        1.81632
H         -5.04114        1.53196        1.37722
H         -5.18757        0.52415        2.84014
H         -5.25318       -0.24881        1.24211
C         -2.67188        1.51436        2.81189
H         -2.80248        2.50364        2.33053
H         -3.22730        1.53600        3.77394
H         -1.59968        1.35172        3.02918
C         -2.37905       -1.33414       -0.41319
C         -1.28700       -2.16747       -0.80010
C         -1.57899       -3.40030       -1.43217
C         -2.88568       -3.85355       -1.63657
H         -3.06412       -4.82171       -2.12833
C         -3.95544       -3.07128       -1.18434
H         -4.99443       -3.41532       -1.29742
C          0.16967       -1.90858       -0.53590
C          0.76425       -2.45872        0.63519
C         -0.02846       -3.34489        1.59853
C          0.14947       -4.82641        1.20980
H          1.21385       -5.12718        1.30288
H         -0.16470       -5.02413        0.16755
H         -0.44954       -5.48072        1.87632
C          0.32227       -3.15582        3.08260
H          0.20857       -2.10105        3.39906
H         -0.35177       -3.77509        3.70850
H          1.35845       -3.48303        3.30847
H         -1.09998       -3.08723        1.47599
C          2.14420       -2.26318        0.84910
H          2.59800       -2.69342        1.75263
C          2.95554       -1.56923       -0.06713
C          4.45258       -1.35614        0.14475
C          4.76581        0.12035        0.45394
H          4.33366        0.41258        1.43576
H          4.36645        0.80212       -0.32508
H          5.86073        0.28787        0.51915
H          4.93508       -1.59125       -0.83080
C          5.07136       -2.27678        1.20121
H          4.86034       -3.34513        0.99444
H          6.17155       -2.14537        1.23093
H          4.68821       -2.04476        2.21687
C          2.35074       -1.08712       -1.24207
H          2.97462       -0.56845       -1.98548
C          0.98136       -1.26216       -1.50686
C          0.42117       -0.89430       -2.87629
H         -0.68148       -0.84407       -2.77263
C          0.73363       -2.01732       -3.88426
H          0.29605       -1.78605       -4.87744
H          0.33042       -2.99399       -3.55208
H          1.83001       -2.13293       -4.01216
C          0.89863        0.46146       -3.40947
H          0.36264        0.71068       -4.34791
H          0.71099        1.26235       -2.67006
H          1.98289        0.44705       -3.64584
C         -3.69318       -1.83213       -0.59019
C         -3.13316        1.50623       -1.02269
C         -3.26333        2.91898       -0.42473
H         -2.30614        3.31462       -0.04080
H         -4.01383        2.96796        0.38770
H         -3.60154        3.61047       -1.22501
C         -2.20811        1.54956       -2.25066
H         -2.66778        2.21258       -3.01442
H         -1.20654        1.94558       -2.00019
H         -2.10447        0.54508       -2.70620
C         -4.51517        1.02721       -1.50127
H         -5.25824        0.91521       -0.69212
H         -4.45269        0.07904       -2.06694
H         -4.90744        1.79594       -2.20062
H         -0.73158       -4.02361       -1.75334
H         -4.54489       -1.23476       -0.24733

