%nprocs=48
%mem=350GB
%chk=3h-ptbu3-6ome16-t2-h2o.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd        -0.05723       -0.24494       -0.05883
O          0.23458        1.19193        1.58763
H          0.66389        0.82579        2.38525
B          0.96217        2.33787        1.14731
O          0.89739        2.82865       -0.10501
O          1.68241        2.95156        2.14334
O          0.13583       -1.10973       -1.88049
H          1.04658       -1.46879       -1.89007
O          0.41651        1.50845       -2.41177
H         -0.26658        1.79575       -3.04285
H          0.29986        0.49668       -2.33210
C          1.92156       -0.52497        0.14703
C          2.86908        0.10516       -0.65391
C          2.37014       -1.34958        1.22761
C          3.72245       -1.51421        1.49433
C          4.71333       -0.86787        0.69412
C          4.26915       -0.04318       -0.40463
C          5.25505        0.60364       -1.20036
C          6.61147        0.45549       -0.94260
C          7.04562       -0.36199        0.14294
C          6.10309       -1.00943        0.94236
H          1.63398       -1.87614        1.85847
H          4.05012       -2.15569        2.32832
H          2.56087        0.75171       -1.49165
H          6.45882       -1.63487        1.77458
H          4.92468        1.23614       -2.03932
H          7.34151        0.97140       -1.58068
H          0.60383        2.25713       -0.88155
H          2.19982        3.68863        1.77321
P         -2.53533       -0.19498       -0.06854
C         -3.31726       -1.29259       -1.46771
C         -2.85711       -2.74363       -1.22013
H         -3.34039       -3.20868       -0.34104
H         -1.75538       -2.79408       -1.11197
H         -3.13550       -3.35361       -2.10561
C         -2.71356       -0.88685       -2.83207
H         -1.60926       -0.95070       -2.80730
H         -3.02781        0.11469       -3.16956
H         -3.08046       -1.61244       -3.59001
C         -4.85107       -1.24049       -1.57562
H         -5.37252       -1.50529       -0.63857
H         -5.21083       -0.24687       -1.90461
H         -5.17254       -1.96904       -2.35111
C         -2.97756       -1.00801        1.64692
C         -1.94478       -2.13064        1.89783
H         -2.08355       -2.52585        2.92715
H         -0.90753       -1.74116        1.80513
H         -2.03634       -2.97592        1.19495
C         -2.76884        0.02886        2.76917
H         -1.77649        0.51343        2.70773
H         -2.83197       -0.49698        3.74573
H         -3.54263        0.81838        2.77573
C         -4.39666       -1.58594        1.77569
H         -4.57207       -2.43537        1.08978
H         -5.18361       -0.82877        1.60099
H         -4.53262       -1.97170        2.80941
C         -3.37880        1.55114       -0.14341
C         -3.33065        2.04711       -1.60166
H         -3.58264        3.12869       -1.61587
H         -2.31243        1.93278       -2.02366
H         -4.05384        1.53099       -2.25902
C         -2.52277        2.55043        0.66224
H         -3.00397        3.54993        0.59716
H         -1.50571        2.64423        0.24046
H         -2.42722        2.29627        1.73018
C         -4.83090        1.59916        0.36238
H         -5.23050        2.62520        0.20967
H         -5.49734        0.90116       -0.17528
H         -4.90655        1.38353        1.44460
O          8.35822       -0.55978        0.46336
C          9.35037        0.07382       -0.31737
H          9.31858       -0.25051       -1.38248
H         10.32485       -0.22200        0.11457
H          9.26707        1.18409       -0.28369

