%nprocs=48
%mem=350GB
%chk=2i-ptbu2cy-01-rxt.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd         0.36643        1.71456        0.00662
O          1.22700        2.52681       -1.59026
H          0.44815        2.72876       -2.14917
O         -1.55208        2.73260       -0.01757
O         -2.82156        2.45832        2.04437
H         -1.52996        3.61284        0.40564
B         -2.12577        1.75134        1.01663
O         -0.82378        1.15575        1.66501
C         -2.84764        0.51576        0.27990
C         -2.64960        0.24157       -1.07207
C         -3.59240       -0.43570        1.04549
C         -4.09188       -1.60091        0.48359
C         -3.86021       -1.90481       -0.89035
C         -3.12240       -0.95413       -1.68762
C         -2.86911       -1.25752       -3.05846
C         -3.31947       -2.44239       -3.62212
C         -4.05039       -3.37600       -2.83703
C         -4.31512       -3.11050       -1.50113
H         -3.75695       -0.24287        2.11914
H         -4.65883       -2.32102        1.09568
H         -2.08450        0.95647       -1.69222
H         -4.40567       -4.31227       -3.29415
H         -4.88037       -3.83227       -0.89005
H         -2.30146       -0.53058       -3.66111
H         -3.11345       -2.66394       -4.68055
H         -3.77357        2.27074        2.00829
H         -0.62441        1.72617        2.43540
P          2.02687        0.20509        0.16334
C          3.47718        0.99073        1.13378
C          2.97875        1.18229        2.58115
H          2.83060        0.22881        3.12278
H          2.02643        1.75090        2.59969
H          3.73220        1.77294        3.14314
C          3.75053        2.39045        0.54626
H          4.51977        2.89162        1.17153
H          2.83376        3.01211        0.54244
H          4.12454        2.35439       -0.49155
C          4.77298        0.16062        1.12313
H          4.63908       -0.85992        1.52778
H          5.20337        0.07481        0.10763
H          5.52936        0.67238        1.75586
C          2.57026       -0.50089       -1.52817
C          3.52265        0.48408       -2.23196
H          3.71086        0.10505       -3.25917
H          3.04746        1.48204       -2.30573
H          4.50570        0.56508       -1.73028
C          1.30255       -0.62042       -2.40222
H          0.87438        0.38619       -2.56740
H          0.52496       -1.27189       -1.96419
H          1.59356       -1.05186       -3.38364
C          3.23895       -1.87805       -1.37765
H          3.58758       -2.20991       -2.37881
H          4.12133       -1.85773       -0.70992
H          2.53488       -2.64657       -1.00578
C          1.30147       -1.16008        1.23777
C          2.23042       -2.20493        1.88704
H          3.08769       -1.72250        2.39493
H          2.65887       -2.87116        1.11065
C          1.44907       -3.04946        2.90793
H          2.12404       -3.80771        3.35814
C          0.22123       -3.71921        2.28032
H          0.56086       -4.46511        1.52619
H         -0.34252       -4.28864        3.04888
C         -0.68330       -2.68828        1.59694
H         -1.54147       -3.18051        1.09526
H         -1.12201       -2.00293        2.35501
H          1.11931       -2.38893        3.74148
C          0.09120       -1.84938        0.57328
H          0.44112       -2.51411       -0.24592
H         -0.58299       -1.09716        0.11921
H          0.87374       -0.53802        2.05513

