%nprocs=48
%mem=350GB
%chk=3e-pcy3-01-rxt.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd        -0.02853        0.31977       -1.47952
O         -0.67378       -0.80769       -2.98219
H         -1.59010       -0.48270       -3.09858
O         -1.14686        2.17924       -1.71703
O         -0.44837        3.94129       -0.19665
H         -0.72074        2.83605       -2.30079
B         -0.82068        2.56293       -0.27020
O          0.46419        1.70835        0.03045
C         -1.96552        1.98751        0.70656
C         -3.14614        1.43091        0.21871
C         -1.74361        1.93832        2.11988
C         -2.65263        1.34800        2.98434
C         -3.84996        0.75193        2.48819
C         -4.10444        0.80423        1.06853
C         -5.29250        0.19754        0.56196
C         -6.18578       -0.44192        1.40928
C         -5.93040       -0.49812        2.80686
C         -4.78910        0.09038        3.33294
H         -0.80964        2.36124        2.52489
H         -2.45553        1.31223        4.06822
H         -3.33811        1.44906       -0.86628
H         -6.64378       -1.00929        3.47129
H         -4.58941        0.05009        4.41575
H         -5.48321        0.24083       -0.52218
H         -7.09495       -0.91026        1.00220
H         -1.04364        4.42539        0.39778
H          1.22712        2.25986       -0.23802
P          0.93643       -1.52304       -0.70274
C          2.25413       -1.04365        0.52468
C          3.42065       -0.26808       -0.11432
C          4.32604        0.33153        0.97008
H          5.17158        0.87740        0.50164
H          3.74643        1.08466        1.54982
C          4.84750       -0.75484        1.91995
H          5.46875       -0.30459        2.72214
H          5.51823       -1.43961        1.35314
C          3.69824       -1.56874        2.52826
H          3.09367       -0.91053        3.19175
H          4.09465       -2.38190        3.17180
H          3.03165        0.51849       -0.79482
H          4.02131       -0.95744       -0.74618
H          1.68904       -0.31161        1.14724
C          2.77788       -2.15820        1.44760
H          3.34155       -2.90447        0.84699
H          1.93977       -2.70459        1.92566
C          1.53686       -2.62739       -2.06250
C          2.47022       -1.91315       -3.05820
H          3.44647       -1.69513       -2.57386
H          2.02322       -0.94231       -3.35301
C          2.71040       -2.80191       -4.28594
H          3.40014       -2.29457       -4.99254
C          3.26612       -4.17537       -3.88623
H          4.27913       -4.04342       -3.44214
H          3.40105       -4.81714       -4.78205
C          2.35970       -4.87358       -2.86388
H          2.79911       -5.84381       -2.54996
H          1.38255       -5.11027       -3.34123
H          1.74686       -2.93281       -4.82634
C          2.10608       -3.98931       -1.63256
H          3.06483       -3.83695       -1.08946
H          1.42146       -4.50458       -0.92719
H          0.57572       -2.78113       -2.60469
C         -0.30402       -2.51384        0.27794
C         -0.88237       -1.65882        1.42430
H         -0.07592       -1.30307        2.09804
H         -1.34450       -0.74538        0.99131
C         -1.93558       -2.42971        2.22975
H         -2.34854       -1.76919        3.01898
H         -1.45117       -3.28858        2.74889
C         -3.05754       -2.94625        1.32429
H         -3.60128       -2.07801        0.89242
C         -2.48997       -3.81270        0.19480
H         -2.03852       -4.73318        0.63107
H         -3.30044       -4.15562       -0.48217
H         -3.80392       -3.51642        1.91575
H          0.25628       -3.37216        0.71654
C         -1.42436       -3.06891       -0.62289
H         -1.87595       -2.22408       -1.18539
H         -1.00020       -3.74703       -1.39190

