%nprocs=48
%mem=350GB
%chk=3x-tbubrettphos-67-t4ob-h2o.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd         1.31318       -0.49279       -0.31506
O          0.59529        0.09377        1.45010
H          0.13062        0.92412        1.22110
H          2.02951        3.19750       -0.64835
C          2.45796        2.47566        0.05954
C          2.38031        2.69639        1.42093
C          3.06951        1.28548       -0.44279
C          3.61325        0.34366        0.44658
C          3.56447        0.56920        1.85970
C          2.92418        1.75907        2.35574
C          2.84606        1.96109        3.76142
C          3.37155        1.02542        4.64338
C          4.00230       -0.14741        4.15297
C          4.09810       -0.36863        2.78480
H          3.19595        1.14251       -1.52507
H          4.13084       -0.55007        0.06522
H          1.88488        3.59932        1.80986
H          4.41269       -0.88318        4.86112
H          4.57388       -1.28126        2.39413
H          2.34964        2.86843        4.13984
H          3.29752        1.19067        5.72915
H          1.38019       -1.35711       -4.94062
H          1.98212       -0.63985       -3.71581
O          2.07716       -0.71275       -4.71779
O          2.20046       -1.05400       -2.09605
B          3.26120       -1.90368       -2.15825
H          4.51128       -3.08586       -1.24499
O          3.77623       -2.49803       -0.99252
O          3.87810       -2.23644       -3.34898
H          3.41579       -1.75555       -4.08701
P         -0.43099       -1.96014       -0.05673
C          0.01234       -2.97500        1.55142
C         -0.77903       -2.37762        2.72838
H         -0.42113       -2.85496        3.66575
H         -0.58801       -1.29113        2.79323
H         -1.86426       -2.56760        2.64061
C          1.52122       -2.77940        1.81835
H          1.80270       -3.43237        2.67260
H          1.74503       -1.73455        2.09618
H          2.15438       -3.05676        0.95239
C         -0.24372       -4.48687        1.43657
H         -0.03634       -4.93717        2.43043
H         -1.28237       -4.73191        1.16783
H          0.44008       -4.97092        0.71584
C         -2.16215       -1.21336        0.05918
C         -3.24382       -2.13309        0.24945
O         -2.92163       -3.37197        0.71992
C         -3.93751       -4.34298        0.86664
H         -4.42815       -4.57902       -0.10400
H         -4.71204       -4.02152        1.59721
H         -3.44063       -5.25437        1.24935
C         -4.57356       -1.77326       -0.00397
H         -5.38209       -2.50642        0.10504
C         -4.88633       -0.46598       -0.38503
H         -5.93159       -0.19934       -0.58610
C         -3.86905        0.49227       -0.44429
O         -4.11643        1.81269       -0.69679
C         -5.45269        2.23396       -0.87494
H         -6.07614        2.02384        0.02378
H         -5.41151        3.32686       -1.03740
H         -5.92794        1.75537       -1.76104
C         -2.49796        0.14999       -0.19997
C         -1.65469        1.39375       -0.05629
C         -1.64500        2.01263        1.23184
C         -2.20197        1.31827        2.47453
C         -1.27181        1.42964        3.69392
H         -1.66966        0.82129        4.53173
H         -1.19146        2.47418        4.06103
H         -0.25406        1.06321        3.45368
C         -3.60883        1.85103        2.80458
H         -3.57053        2.92850        3.06931
H         -4.29672        1.74370        1.94392
H         -4.04383        1.30448        3.66670
H         -2.29697        0.24124        2.23642
C         -1.16799        3.33061        1.34925
H         -1.16361        3.80693        2.34272
C         -0.73290        4.07727        0.24249
C         -0.36585        5.54739        0.40031
H         -0.23161        5.72911        1.48982
C         -1.53539        6.43081       -0.07444
H         -1.71985        6.28534       -1.15933
H         -2.47222        6.17658        0.46041
H         -1.31879        7.50619        0.09356
C          0.94127        5.94254       -0.30206
H          1.80506        5.35937        0.07321
H          1.16234        7.01672       -0.13727
H          0.87901        5.78716       -1.39898
C         -0.73451        3.44198       -1.00847
H         -0.39541        3.99750       -1.89677
C         -1.18762        2.12111       -1.18058
C         -1.21386        1.53304       -2.58340
H         -1.49216        0.46638       -2.47716
C         -2.27575        2.20664       -3.46972
H         -3.28120        2.14293       -3.01230
H         -2.04173        3.28109       -3.62278
H         -2.30791        1.72668       -4.46955
C          0.17239        1.59014       -3.23873
H          0.19694        1.04055       -4.19992
H          0.93473        1.13164       -2.57947
H          0.48181        2.63537       -3.44816
C         -0.55718       -3.09077       -1.63204
C         -0.69800       -2.10424       -2.80568
H          0.15854       -1.40999       -2.85096
H         -0.73170       -2.68589       -3.75254
H         -1.64240       -1.52866       -2.73816
C         -1.72503       -4.08473       -1.73251
H         -1.60559       -4.63065       -2.69321
H         -2.70860       -3.57830       -1.76879
H         -1.72687       -4.83318       -0.92200
C          0.76399       -3.88114       -1.74616
H          0.96759       -4.09636       -2.81574
H          1.63970       -3.33862       -1.35061
H          0.69814       -4.85320       -1.22283

