%nprocs=48
%mem=350GB
%chk=3n-tbuxphos-67-t3ob-2h2o.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd         0.10932        1.22033        0.11696
O          0.04126        2.55668       -1.48656
B          1.11229        3.18520       -0.96756
O          1.94056        2.36676       -0.14037
O          1.48141        4.50677       -1.15567
O          0.64718        0.44055        1.92538
H          1.23652       -0.30672        1.68175
O          1.97245        2.55895        2.41183
H          2.64754        2.48814        3.10826
H          1.47443        1.63336        2.34384
H          2.20185        2.67272        0.78690
H          0.81321        4.94053       -1.71817
O          0.03539        4.43270        1.53428
H          0.55556        4.83883        0.81339
H          0.71066        3.88809        2.00307
P         -1.94731        0.29520        0.13908
C         -2.72602        0.52168        1.89122
C         -2.23242       -0.65269        2.75257
H         -2.52864       -0.46788        3.80706
H         -2.67149       -1.62016        2.43960
H         -1.12925       -0.71131        2.71035
C         -4.26168        0.57601        1.92505
H         -4.67007        1.45487        1.39135
H         -4.57180        0.66749        2.98767
H         -4.74271       -0.33972        1.53092
C         -2.16638        1.83887        2.46748
H         -2.34945        2.71492        1.81878
H         -2.65413        2.02855        3.44754
H         -1.07780        1.76285        2.63048
C         -2.01502       -1.53032       -0.23297
C         -0.88973       -2.35577       -0.53420
C         -1.12979       -3.69094       -0.93668
C         -2.41434       -4.24204       -0.99006
H         -2.55397       -5.28739       -1.30430
C         -3.50980       -3.45636       -0.61069
H         -4.52792       -3.87359       -0.60371
C          0.55295       -1.97342       -0.35895
C          1.20591       -2.33237        0.85471
C          0.49613       -3.11156        1.96175
C          0.79392       -4.61796        1.83610
H          1.88153       -4.81059        1.94493
H          0.47809       -5.02142        0.85513
H          0.26515       -5.18959        2.62654
C          0.84115       -2.62209        3.37821
H          0.72252       -1.52475        3.46982
H          0.17620       -3.10641        4.12151
H          1.88273       -2.88072        3.66035
H         -0.59397       -2.97070        1.81672
C          2.56180       -1.98307        1.01931
H          3.07201       -2.24388        1.96005
C          3.28952       -1.30297        0.02770
C          4.71558       -0.84895        0.30154
C          5.67568       -1.14003       -0.86072
H          5.41810       -0.54277       -1.75955
H          5.65480       -2.21048       -1.14770
H          6.71644       -0.87667       -0.58268
H          5.06923       -1.42630        1.18449
C          4.73810        0.64426        0.67955
H          4.06368        0.85934        1.53227
H          5.76388        0.96776        0.95262
H          4.38589        1.26928       -0.16581
C          2.64017       -1.02258       -1.18521
H          3.19300       -0.51162       -1.98580
C          1.29309       -1.36111       -1.40770
C          0.67976       -1.17526       -2.79035
H         -0.41672       -1.09903       -2.65087
C          0.94756       -2.42812       -3.64774
H          0.47936       -2.32415       -4.64833
H          0.54515       -3.34621       -3.17672
H          2.03807       -2.57410       -3.79369
C          1.14510        0.09018       -3.52066
H          0.56635        0.21971       -4.45765
H          0.99711        0.99350       -2.89742
H          2.21472        0.02830       -3.81024
C         -3.30158       -2.12144       -0.24511
C         -3.03471        1.11819       -1.22539
C         -3.07722        2.62238       -0.89251
H         -2.05996        3.03074       -0.74081
H         -3.69536        2.83448        0.00154
H         -3.53704        3.15959       -1.74900
C         -2.30244        0.88942       -2.56003
H         -2.87610        1.39898       -3.36338
H         -1.28380        1.31346       -2.54512
H         -2.26489       -0.18871       -2.81555
C         -4.46781        0.58219       -1.39670
H         -5.08173        0.62867       -0.48090
H         -4.48215       -0.45164       -1.78953
H         -4.96681        1.22039       -2.15668
H         -0.25952       -4.31376       -1.19125
H         -4.17118       -1.52209        0.04717

