%nprocs=48
%mem=350GB
%chk=unlig-pdoh2-03-int1.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd         1.54630        0.74562       -0.20155
O          2.52148        1.39891        1.46208
O          3.62538       -0.26326        3.02443
H          3.20201        2.04199        1.16813
B          3.45708        0.00844        1.64132
O          4.68701        0.29132        0.97525
C          2.48430       -0.97342        0.75550
C          1.07340       -1.02553        1.00932
C          3.01245       -1.88115       -0.24009
C          2.20284       -2.77604       -0.90113
C          0.78165       -2.83080       -0.66239
C          0.20360       -1.95307        0.31771
C         -1.19525       -1.98108        0.54944
C         -2.01466       -2.84360       -0.17575
C         -1.45004       -3.71228       -1.13958
C         -0.07578       -3.70984       -1.37514
H          4.09261       -1.82753       -0.44294
H          2.62761       -3.46635       -1.64733
H          0.64791       -0.50500        1.88560
H         -2.10140       -4.39128       -1.71040
H          0.36110       -4.38431       -2.12784
H         -1.63133       -1.29274        1.28883
H         -3.10086       -2.83959       -0.00238
H          5.39537        0.31895        1.64189
H          2.80077       -0.56422        3.43886
B         -0.20194        1.58036       -2.06716
O          0.85941        2.42507       -1.31244
H          0.41576        3.10886       -0.77554
C         -1.59906        1.41866       -1.27942
C         -1.70770        1.52722        0.10691
H         -0.84204        1.85621        0.71118
C         -2.89438        1.18029        0.81634
C         -2.98175        1.24774        2.23868
H         -2.10995        1.61446        2.80446
C         -4.13636        0.85561        2.90097
H         -4.18826        0.90930        3.99909
C         -5.25894        0.38625        2.16528
H         -6.17113        0.08044        2.69985
C         -5.20758        0.31542        0.78034
H         -6.07672       -0.04501        0.20743
C         -4.03346        0.70321        0.07026
C         -3.93061        0.63098       -1.35051
H         -4.80489        0.28503       -1.92531
C         -2.75621        0.97982       -1.99905
H         -2.69224        0.91700       -3.09658
O         -0.35517        1.95496       -3.41423
H          0.51280        1.97564       -3.85557
O          0.58819        0.21345       -1.92940
H         -0.04866       -0.51617       -1.78406

