%nprocs=48
%mem=350GB
%chk=9e-pcbu3-39-t2-lig.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd        -0.37297       -1.25637        0.58001
O          0.01186       -2.30985        2.21883
H          0.96820       -2.50882        2.16756
O         -0.66259       -0.06864       -1.22059
O         -0.89604       -2.06075       -2.50965
H         -0.27780        0.89484       -1.20269
B         -0.72899       -0.69961       -2.44797
O         -0.65447        0.06632       -3.59030
C          1.62273       -1.19336        0.24700
C          2.49675       -0.69326        1.21253
C          2.17815       -1.64293       -0.99438
C          3.54233       -1.57557       -1.24486
C          4.44099       -1.02709       -0.28364
C          3.90128       -0.57510        0.97578
C          4.78811        0.00064        1.93343
C          6.14303        0.13019        1.66362
C          6.67365       -0.31739        0.42279
C          5.83807       -0.88647       -0.52778
H          1.52005       -2.06388       -1.77035
H          3.94857       -1.93702       -2.20391
H          2.11131       -0.35212        2.18762
H          7.75009       -0.21082        0.21925
H          6.24320       -1.23300       -1.49193
H          4.37311        0.34630        2.89367
H          6.81354        0.57943        2.41235
H         -0.85200       -2.41850       -1.58920
H         -0.68833       -0.49302       -4.38655
P         -2.72584       -1.43765        1.10433
C         -3.42718       -3.15616        1.05935
C         -2.52352       -4.21656        1.76610
H         -3.12856       -4.95558        2.32855
C         -2.06940       -4.72423        0.37376
H         -2.05906       -5.81906        0.20402
H         -1.07000       -4.31776        0.11397
H         -1.71086       -3.82170        2.40663
H         -4.47803       -3.09293        1.41611
C         -3.21935       -3.92070       -0.28392
H         -4.10039       -4.55025       -0.52212
H         -2.97641       -3.32824       -1.18882
C         -3.16638       -0.86992        2.81369
C         -2.33931       -1.36340        4.03590
H         -2.78090       -2.18573        4.63340
H         -1.31361       -1.64839        3.72288
C         -2.40321        0.07476        4.61262
H         -3.23199        0.20521        5.33847
H         -1.47537        0.48246        5.06284
H         -4.25499       -1.04933        2.95716
C         -2.78560        0.58745        3.20098
H         -3.57429        1.36162        3.11291
H         -1.89366        0.92472        2.63754
C         -3.95939       -0.46621        0.11264
C         -4.04923       -0.67211       -1.42734
H         -3.13607       -1.13113       -1.84988
C         -4.08680        0.86788       -1.61194
H         -3.41274        1.28835       -2.38514
H         -5.11007        1.25132       -1.79715
H         -4.91947       -1.25256       -1.79205
C         -3.64301        1.03831       -0.13465
H         -2.55848        1.24399       -0.04564
H         -4.19264        1.77138        0.48814
H         -4.95285       -0.59842        0.59268
P          0.49803        2.77967       -1.13041
C         -0.53161        4.03699       -2.02344
C         -2.02376        4.20988       -1.61741
H         -2.27276        5.05681       -0.94752
C         -2.38386        4.32429       -3.12088
H         -2.44626        5.38054       -3.45249
H         -3.29449        3.79507       -3.46719
H         -2.43258        3.28181       -1.17105
H         -0.00120        5.01423       -2.00583
C         -1.01180        3.68729       -3.46372
H         -0.43149        4.11675       -4.30446
H         -1.08347        2.59049       -3.61419
C          0.77408        3.59583        0.51782
C         -0.39845        3.33866        1.51528
H         -0.53385        4.20140        2.19876
H         -1.39049        3.07399        1.09520
C          0.43722        2.20161        2.15484
H          0.43320        2.11514        3.25953
H          0.17763        1.20723        1.72913
H          1.05431        4.65711        0.34276
C          1.69975        2.78249        1.47403
H          2.26642        3.46391        2.14063
H          2.41088        2.06065        1.02895
C          2.13125        2.95748       -1.98565
C          2.24667        2.36048       -3.42110
H          1.51356        1.54363       -3.58218
C          3.65105        1.81915       -3.04487
H          3.90343        0.78871       -3.36598
H          4.46232        2.49962       -3.37407
H          2.16776        3.07132       -4.26797
C          3.29066        2.01497       -1.55218
H          2.90391        1.07794       -1.10776
H          4.06198        2.42720       -0.87284
H          2.44171        4.02494       -1.96540

