%nprocs=48
%mem=350GB
%chk=3g-ptbu2cy-22-c5.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd        -1.12939        0.46172       -0.73082
O         -1.65459        2.33035       -1.62957
H         -2.78705        1.16932       -2.11760
B         -2.20700        2.87543       -0.51570
O         -1.52071        3.76339        0.32949
O         -3.50674        2.52038       -0.10885
O         -2.18949        1.90426        2.33633
H         -1.99678        1.28708        1.59594
H         -1.75447        2.71884        1.98927
C          0.60224        1.15231       -0.06865
C          1.48903        1.61899       -1.03722
C          0.93686        1.31314        1.30991
C          2.14066        1.89667        1.68608
C          3.08276        2.34122        0.71475
C          2.74135        2.20501       -0.68116
C          3.67455        2.65519       -1.66256
C          4.89030        3.20706       -1.28731
C          5.22718        3.33791        0.08813
C          4.33954        2.91540        1.06664
H          0.22981        1.00579        2.09319
H          2.37928        2.02020        2.75480
H          1.24003        1.53699       -2.10706
H          6.19448        3.77872        0.37319
H          4.59355        3.01780        2.13361
H          3.41031        2.55458       -2.72698
H          5.60013        3.54834       -2.05629
O         -3.17256        0.29048       -1.76988
H         -3.73013        0.67615       -1.05219
H         -0.61143        3.86031       -0.01297
H         -3.60091        2.68329        0.85336
P         -0.77008       -1.68358       -0.01105
C         -1.08029       -2.82003       -1.53244
C         -0.42351       -2.12740       -2.74730
H         -0.60018       -2.75108       -3.64937
H          0.66791       -2.00060       -2.63366
H         -0.86840       -1.12829       -2.92988
C         -2.58716       -2.93578       -1.82875
H         -3.13183       -3.51650       -1.06081
H         -2.70762       -3.47844       -2.79037
H         -3.06016       -1.94190       -1.94175
C         -0.47607       -4.22312       -1.35217
H         -0.72061       -4.83152       -2.24894
H          0.62650       -4.19719       -1.26635
H         -0.88235       -4.75464       -0.47169
C         -1.98366       -2.10019        1.42255
C         -3.34795       -1.44085        1.13058
H         -4.02759       -1.63955        1.98565
H         -3.25963       -0.34186        1.02514
H         -3.82815       -1.83327        0.21678
C         -1.42717       -1.46628        2.71457
H         -1.33067       -0.36672        2.63894
H         -0.45348       -1.88707        3.02609
H         -2.14794       -1.66108        3.53627
C         -2.19549       -3.61085        1.63738
H         -2.69468       -4.09277        0.77630
H         -1.25622       -4.15681        1.84024
H         -2.85722       -3.75252        2.51824
C          0.96684       -1.99754        0.64587
C          2.05755       -1.78344       -0.42446
H          1.83239       -0.89019       -1.03569
H          2.07768       -2.65781       -1.11059
C          3.43608       -1.63456        0.23280
H          4.20848       -1.47555       -0.54810
C          3.77566       -2.85753        1.09150
H          3.89324       -3.74627        0.43068
H          4.75077       -2.71928        1.60371
C          2.67086       -3.13984        2.11620
H          2.89708       -4.06233        2.69129
H          2.63796       -2.30922        2.85678
H          3.43543       -0.71597        0.85962
C          1.28526       -3.26859        1.45924
H          1.27001       -4.16049        0.79946
H          0.53057       -3.44765        2.24752
H          1.05076       -1.13629        1.34591

