%nprocs=48
%mem=350GB
%chk=3d-pcpt3-06-c2-h2o.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd         0.44427        0.95479       -0.16683
O          0.38831        2.98752       -0.93185
H         -0.09711        3.58679       -0.33353
B          1.88523        3.23487       -0.71177
O          1.97547        4.43275        0.05949
O          2.60941        3.19320       -1.98097
O          2.37001        1.98676        0.02791
H          3.04702        1.57789       -0.54419
O          1.14983        1.17261       -3.19288
H          0.32915        1.59329       -2.86990
H          1.80516        1.86930       -2.92505
C         -1.44722        0.45640       -0.44940
C         -2.41138        0.61976        0.54381
C         -1.86541        0.05376       -1.75668
C         -3.20486       -0.18172       -2.03475
C         -4.20573       -0.03759       -1.02956
C         -3.79671        0.38135        0.28906
C         -4.79173        0.53291        1.30014
C         -6.12847        0.28131        1.02756
C         -6.53080       -0.13193       -0.27191
C         -5.58718       -0.28657       -1.27734
H         -1.11627       -0.06725       -2.55327
H         -3.51165       -0.48490       -3.04902
H         -2.12776        0.94519        1.55692
H         -7.59425       -0.32706       -0.47759
H         -5.89363       -0.60430       -2.28664
H         -4.47713        0.85437        2.30605
H         -6.88409        0.40271        1.81884
H          2.85703        4.49963        0.46199
H          2.55007        4.06449       -2.40981
P          0.88831       -1.11536        0.53927
C          0.81631       -1.29012        2.39430
C         -0.65012       -1.45025        2.90712
C         -0.80815       -0.41948        4.04081
H         -1.86085       -0.09719        4.17498
H         -0.47237       -0.85185        5.00811
C          0.13555        0.71510        3.62671
H          0.36323        1.43077        4.44160
H         -0.30610        1.29670        2.78719
H         -1.37432       -1.21484        2.10110
H         -0.86144       -2.48793        3.23084
C          1.37755       -0.02482        3.11334
H          2.01664       -0.34303        3.96353
H          1.99403        0.61758        2.45578
H          1.42296       -2.18513        2.64408
C         -0.15740       -2.51063       -0.10645
H         -1.19005       -2.19863        0.14378
C          0.15682       -3.89769        0.52381
H         -0.51649       -4.13040        1.37151
C          0.04026       -4.89415       -0.64245
H         -1.02720       -5.14935       -0.81793
C          0.58323       -4.09808       -1.83611
H          0.34321       -4.55085       -2.81877
H          1.69178       -4.03409       -1.77068
H          0.57937       -5.84462       -0.45439
H          1.19273       -3.93032        0.92580
C         -0.04684       -2.70753       -1.65234
H         -1.06825       -2.69512       -2.08144
H          0.51065       -1.89975       -2.16321
C          2.63346       -1.57116        0.06120
H          2.69335       -2.67421        0.18967
C          3.00045       -1.20384       -1.41340
H          2.29290       -0.47189       -1.85946
H          2.95687       -2.10904       -2.05031
C          4.43955       -0.62875       -1.35618
H          4.41761        0.48090       -1.44233
C          4.98372       -1.03841        0.02136
H          5.34414       -2.08985       -0.00775
H          5.82864       -0.40997        0.36814
H          5.07029       -0.97934       -2.19662
C          3.74815       -0.93563        0.92576
H          3.86707       -1.43478        1.90782
H          3.52609        0.13269        1.12230

