%nprocs=48
%mem=350GB
%chk=3h-ruphos-22-c5.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd        -0.34565       -1.08932        0.57788
O         -1.05997       -3.05955        0.62234
H         -2.13751       -2.02411        1.59751
B         -1.90737       -3.78379       -0.12690
O         -1.86518       -5.17187       -0.20007
O         -2.97238       -3.18950       -0.84553
O         -0.87234       -2.83357       -2.84750
H         -0.09668       -2.61984       -2.29415
H         -1.61748       -2.67645       -2.23016
C          1.22254       -1.44890       -0.56312
C          2.12974       -2.42169       -0.14546
C          1.44648       -0.78260       -1.80646
C          2.56743       -1.06705       -2.57461
C          3.53069       -2.02705       -2.14911
C          3.29622       -2.72865       -0.90910
C          4.25242       -3.69741       -0.48009
C          5.38790       -3.96020       -1.23186
C          5.61860       -3.26676       -2.45175
C          4.70660       -2.32206       -2.89907
H          0.71447       -0.04643       -2.16448
H          2.72547       -0.54814       -3.53438
H          1.96701       -2.96367        0.79934
H          6.52218       -3.48493       -3.04114
H          4.87747       -1.78484       -3.84560
H          4.07071       -4.23355        0.46482
H          6.11554       -4.71047       -0.88610
O         -2.16273       -1.06197        1.88745
H         -2.81013       -0.62038        1.27512
H         -1.07304       -5.47576        0.27747
H         -3.43450       -3.89469       -1.33597
P          0.42232        0.94139        1.17583
C          1.89291        1.76604        0.33538
C          2.04266        3.26588        0.64873
C          3.20443        3.89475       -0.13819
H          3.31559        4.96078        0.15275
H          2.94180        3.89655       -1.21883
C          4.52409        3.13817        0.04439
H          5.31900        3.59025       -0.58540
H          4.86477        3.24077        1.09967
C          4.34638        1.65206       -0.28128
H          4.09592        1.52504       -1.35828
H          5.29122        1.09382       -0.11614
H          1.10320        3.80290        0.41454
H          2.22840        3.40205        1.73836
H          1.62008        1.66702       -0.73697
C          3.22707        1.03280        0.56551
H          3.51148        1.12061        1.63691
H          3.12723       -0.04510        0.34052
C          0.89937        0.76218        2.99393
C         -0.30664        0.69771        3.95355
C          0.15474        0.55654        5.41132
H         -0.73203        0.50873        6.07780
H          0.71917        1.47001        5.70910
C          1.04506       -0.67481        5.61302
H          1.40487       -0.73082        6.66205
H          0.43930       -1.59159        5.43691
C          2.22443       -0.66315        4.63528
H          2.90709        0.18071        4.88601
H          2.82635       -1.59054        4.73668
H         -0.95455        1.58870        3.85141
H         -0.93826       -0.16837        3.66570
H          1.52669        1.64927        3.24740
C          1.74824       -0.51675        3.18425
H          1.11119       -1.38648        2.90661
H          2.60928       -0.54457        2.49213
C         -0.88499        2.25474        1.14541
C         -0.85322        3.27807        2.12132
C         -1.84767        4.26055        2.18700
H         -1.79544        5.04254        2.95947
C         -2.90706        4.23450        1.26770
H         -3.70461        4.99155        1.31424
C         -2.93283        3.24958        0.27481
H         -3.74055        3.23896       -0.47247
H         -0.02805        3.31185        2.84627
C         -1.92657        2.26203        0.18108
C         -2.00118        1.35144       -1.00161
C         -3.00180        0.35547       -1.10596
O         -3.75949        0.15216        0.02795
C         -5.05190       -0.51361       -0.07157
C         -6.03083        0.34682       -0.86307
H         -5.66669        0.54658       -1.88909
H         -7.01000       -0.16600       -0.94104
H         -6.18565        1.31800       -0.35051
C         -5.50633       -0.74893        1.36249
H         -6.48362       -1.26947        1.36665
H         -5.61927        0.21569        1.89750
H         -4.78043       -1.37228        1.91897
H         -4.88711       -1.49699       -0.56222
C         -3.18034       -0.37498       -2.29302
H         -3.91299       -1.18706       -2.34117
C         -2.36871       -0.09444       -3.39617
C         -1.39948        0.91339       -3.34441
H         -0.77510        1.10919       -4.22444
H         -2.47306       -0.69512       -4.31006
C         -1.21762        1.63855       -2.15060
O         -0.31403        2.65422       -2.01380
C          0.17258        3.33952       -3.18969
C          0.33217        4.80270       -2.79304
H          0.67074        5.40505       -3.65905
H         -0.62983        5.21245       -2.42941
H          1.08067        4.90805       -1.98286
H         -0.61001        3.26218       -3.97757
C          1.46985        2.71055       -3.69524
H          2.26050        2.77043       -2.92134
H          1.33665        1.64393       -3.95893
H          1.82943        3.24468       -4.59739

