%nprocs=48
%mem=350GB
%chk=3m-cyjohnphos-6cn16-t2-h2o.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd         0.10853        0.60414       -0.05026
O          0.29182       -1.05413        1.33482
H          0.07059       -1.89900        0.87608
B          1.00890       -1.28156        2.52698
O          1.40132       -0.29420        3.35269
O          1.24186       -2.61202        2.80271
O         -0.06742        2.15114       -1.27509
H          0.81095        2.25124       -1.69038
O          0.97073        2.20143        2.53186
H          1.84428        2.54500        2.25493
H          0.58339        1.91830        1.65239
C          2.12539        0.82030       -0.09263
C          2.94927       -0.30003        0.01867
C          2.75372        2.10592       -0.18061
C          4.13531        2.24659       -0.14654
C          4.98313        1.10590       -0.03430
C          4.36932       -0.19775        0.04616
C          5.21152       -1.34581        0.15608
C          6.58825       -1.22719        0.18522
C          7.19844        0.06748        0.10469
C          6.39883        1.20990       -0.00214
H          2.12621        3.00795       -0.27936
H          4.59546        3.24607       -0.20922
H          2.51315       -1.30842        0.08639
H          6.86955        2.20247       -0.06340
H          4.74057       -2.33915        0.22266
H          7.23019       -2.11532        0.27142
H          1.22708        0.65362        3.06104
H          1.70721       -2.69379        3.65400
P         -2.30554        0.57789        0.04628
C         -3.28999       -1.00248       -0.00922
C         -2.75390       -2.25927       -0.41949
C         -1.34693       -2.48429       -0.85547
C         -0.58575       -3.50280       -0.22838
H         -1.03415       -4.08316        0.59247
C          0.73893       -3.76090       -0.62145
H          1.31617       -4.53748       -0.09841
C          1.32414       -3.01514       -1.65716
H          2.36228       -3.21049       -1.96428
C          0.58012       -2.00672       -2.28843
H          1.03231       -1.40744       -3.09216
C         -0.73945       -1.73984       -1.89073
H         -1.31770       -0.96799       -2.41196
C         -3.58994       -3.40139       -0.38299
H         -3.17173       -4.36403       -0.71354
C         -4.92203       -3.33175        0.03563
C         -5.44941       -2.09988        0.44612
H         -6.49236       -2.02195        0.78817
H         -5.54552       -4.23844        0.04184
C         -4.63606       -0.96066        0.42444
H         -5.06183       -0.01011        0.77292
C         -2.86151        1.36842        1.65386
C         -2.34861        0.54887        2.85306
C         -2.71831        1.20642        4.18888
H         -2.29845        0.60903        5.02503
H         -3.82485        1.19349        4.31658
C         -2.21337        2.65302        4.25059
H         -2.49455        3.12285        5.21631
H         -1.10255        2.65409        4.19943
C         -2.76267        3.47126        3.07624
H         -3.87109        3.54355        3.16234
H         -2.37803        4.51197        3.11055
H         -2.74494       -0.48713        2.80160
H         -1.24464        0.46251        2.79081
H         -3.97378        1.36235        1.67938
C         -2.39955        2.83683        1.72587
H         -1.30011        2.88760        1.58124
H         -2.84584        3.42495        0.89838
C         -3.04325        1.67300       -1.28282
C         -2.73878        1.14264       -2.69407
C         -3.19899        2.13640       -3.77024
H         -3.00354        1.71593       -4.77910
H         -2.57776        3.05571       -3.68757
C         -4.67822        2.50713       -3.61688
H         -4.97311        3.25862       -4.37911
H         -5.30467        1.60606       -3.80657
C         -4.96997        3.03089       -2.20594
H         -4.42462        3.98827       -2.04841
H         -6.04990        3.26119       -2.08864
H         -1.64508        0.98835       -2.77799
H         -3.25282        0.16589       -2.84537
H         -2.42521        2.59030       -1.15672
C         -4.53175        2.02174       -1.13272
H         -5.13921        1.09720       -1.24450
H         -4.74864        2.42856       -0.12313
C          8.62653        0.18456        0.13467
N          9.79791        0.27227        0.15946

