%nprocs=48
%mem=350GB
%chk=3d-pcpt3-16-t2-h2o.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd         0.19730       -0.22521        0.13211
O          0.36549        1.78130        0.94992
H          0.72093        1.99192        1.83180
B          0.47575        2.83943        0.01927
O          0.33916        2.66080       -1.30908
O          0.69455        4.07578        0.58248
O          0.12620       -1.80136       -1.13587
H          1.01727       -2.20525       -1.09414
O          0.35636        0.39217       -2.76982
H          0.27633       -0.48367       -2.26242
H          1.25337        0.35322       -3.15136
C          2.21224       -0.40040        0.09191
C          3.02564        0.55442       -0.51659
C          2.83494       -1.54717        0.67979
C          4.21529       -1.70523        0.66578
C          5.06012       -0.73393        0.05433
C          4.44747        0.42346       -0.55240
C          5.28664        1.39731       -1.17170
C          6.66476        1.24161       -1.19297
C          7.26747        0.10128       -0.59413
C          6.47964       -0.86403        0.01571
H          2.21305       -2.31916        1.16273
H          4.67750       -2.59081        1.13196
H          2.58616        1.44242       -1.00105
H          8.36203       -0.01232       -0.61649
H          6.94153       -1.74958        0.48063
H          4.81653        2.28019       -1.63390
H          7.29810        2.00282       -1.67402
H          0.29619        1.73471       -1.71916
H          0.76278        4.75472       -0.11207
P         -2.19314       -0.34697        0.25343
C         -2.59492       -1.64171        1.54106
C         -1.83868       -1.39205        2.88629
C         -0.81083       -2.53047        2.99312
H          0.09513       -2.25412        2.40949
H         -0.49186       -2.73128        4.03577
C         -1.51365       -3.71015        2.31329
H         -2.30248       -4.11916        2.98270
H         -0.83048       -4.54584        2.05882
H         -1.35326       -0.39764        2.93147
H         -2.55865       -1.43884        3.72988
C         -2.13715       -3.05649        1.07028
H         -2.97123       -3.64184        0.63574
H         -1.35398       -2.95632        0.28762
H         -3.69272       -1.61849        1.70622
C         -3.24292        1.12078        0.72365
H         -4.30042        0.77804        0.68462
C         -3.06548        2.35114       -0.22071
H         -3.90624        2.40406       -0.93976
C         -3.02612        3.59957        0.70162
H         -3.62774        4.43987        0.30167
C         -3.52424        3.10428        2.06898
H         -4.63558        3.07699        2.09062
H         -3.19441        3.74196        2.91403
H         -1.98497        3.97158        0.79784
H         -2.14027        2.27558       -0.82612
C         -2.97261        1.67496        2.14097
H         -3.42585        1.05869        2.94176
H         -1.87788        1.71359        2.32392
C         -2.97110       -1.04967       -1.28069
H         -2.31043       -1.91965       -1.48582
C         -4.44290       -1.52740       -1.17475
H         -5.02491       -0.89138       -0.47488
H         -4.49988       -2.55963       -0.77731
C         -5.01890       -1.41166       -2.61734
H         -5.82058       -0.64501       -2.64556
C         -3.83514       -0.96754       -3.50292
H         -3.27612       -1.85426       -3.87133
H         -4.15285       -0.38850       -4.39334
H         -5.47632       -2.35901       -2.96592
C         -2.94031       -0.16844       -2.54609
H         -1.91654        0.01255       -2.92548
H         -3.40495        0.82003       -2.34926

