%nprocs=48
%mem=350GB
%chk=2j-ptbu3-03-c1.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd         0.60472       -0.98732        0.56725
O         -0.09790       -2.85951        1.25104
O         -1.77036       -4.28010        0.09805
H          0.69303       -3.43477        1.20695
B         -0.90909       -3.14124       -0.07417
O          0.01349       -3.36873       -1.16550
O          2.08621       -1.16271        1.90712
H          1.54747       -1.51160        2.64914
C         -1.70783       -1.70542       -0.27995
C         -2.09842       -0.86832        0.78318
C         -2.29473       -1.44506       -1.56712
C         -3.24860       -0.46460       -1.75324
C         -3.65821        0.38145       -0.67253
C         -3.05781        0.18347        0.62227
C         -3.43463        1.03655        1.69763
C         -4.36345        2.05242        1.50903
C         -4.95502        2.24713        0.23355
C         -4.61055        1.42565       -0.83370
H         -1.97578       -2.08456       -2.40484
H         -3.70942       -0.30949       -2.74242
H         -1.74105       -1.07593        1.80592
H         -5.69129        3.05297        0.09180
H         -5.06855        1.57705       -1.82392
H         -2.97004        0.87811        2.68367
H         -4.64528        2.70683        2.34778
H         -0.05278       -4.30636       -1.41990
H         -2.39893       -4.12673        0.82276
P          1.57330        0.93609       -0.21661
C          3.41924        0.65930       -0.74634
C          3.42663       -0.16606       -2.04847
H          4.47227       -0.48087       -2.24776
H          3.08663        0.40627       -2.92979
H          2.81314       -1.08410       -1.95489
C          4.19239       -0.18000        0.28936
H          5.22306       -0.31537       -0.10284
H          3.73247       -1.17195        0.43922
H          4.26520        0.29762        1.27922
C          4.17196        1.98546       -0.96687
H          5.17867        1.74734       -1.37194
H          3.67906        2.66188       -1.68713
H          4.32939        2.53692       -0.02099
C          0.59545        1.51242       -1.78413
C          0.35164        0.26939       -2.67443
H          0.16133       -0.65078       -2.08735
H          1.19500        0.06438       -3.35486
H         -0.54707        0.44913       -3.29901
C         -0.77239        2.02459       -1.30294
H         -1.27563        1.29436       -0.64699
H         -1.42701        2.17722       -2.18550
H         -0.70622        2.99101       -0.77040
C          1.26538        2.61244       -2.62537
H          2.20643        2.27652       -3.09897
H          1.46973        3.53418       -2.05000
H          0.57003        2.88427       -3.44831
C          1.47836        2.28150        1.16650
C          2.56989        1.98247        2.21346
H          2.54183        0.91368        2.50973
H          3.58502        2.23403        1.85360
H          2.37360        2.61254        3.10681
C          0.12128        2.12086        1.88599
H          0.07849        2.85685        2.71701
H          0.02413        1.10560        2.31905
H         -0.75373        2.29669        1.23728
C          1.62933        3.72524        0.65725
H          2.58072        3.89165        0.11944
H          0.79655        4.03704       -0.00065
H          1.62281        4.40724        1.53422

