%nprocs=48
%mem=350GB
%chk=9e-pcbu3-45-p1-h2o.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd         0.04423        0.31983        0.18271
O          0.05667        2.34629        0.64232
H         -0.87979        2.56914        0.81308
O          0.29519        2.47356       -2.10818
C         -1.97290        0.54894        0.13571
C         -2.74194        0.04566        1.18369
C         -2.60846        1.38004       -0.84039
C         -3.97471        1.62356       -0.78850
C         -4.78744        1.07174        0.24515
C         -4.14868        0.27965        1.26848
C         -4.94929       -0.25910        2.31931
C         -6.31763       -0.03466        2.35950
C         -6.94691        0.74386        1.34971
C         -6.19517        1.28529        0.31686
H         -1.99547        1.85052       -1.62630
H         -4.45030        2.26060       -1.55227
H         -2.27746       -0.55542        1.98280
H         -8.03308        0.91688        1.39183
H         -6.67707        1.89232       -0.46602
H         -4.45836       -0.86236        3.09994
H         -6.92201       -0.45921        3.17586
H          0.20603        2.62008       -1.11893
P          2.35552        0.52766        0.87817
C          2.31567        0.83616        2.71534
C          1.18499        0.19105        3.56657
H          1.41085       -0.76036        4.09080
C          1.11214        1.49883        4.39282
H          1.73264        1.44197        5.31074
H          0.10451        1.86773        4.67073
H          0.27336        0.05130        2.94729
H          3.31288        0.58664        3.13548
C          1.84090        2.22505        3.23275
H          2.63076        2.96087        3.48369
H          1.12157        2.66686        2.51343
C          3.72119       -0.73075        0.70843
C          5.13998       -0.53108        1.32666
H          5.93097       -0.14944        0.65154
H          5.11958        0.10773        2.23249
C          5.15103       -2.03635        1.68915
H          5.65670       -2.64260        0.91081
H          5.56071       -2.32346        2.67805
H          3.82008       -0.94875       -0.37503
C          3.61169       -2.05675        1.51900
H          3.15289       -2.93358        1.01989
H          3.08713       -1.90245        2.48354
C          3.03721        2.09368        0.17933
C          3.52477        2.13237       -1.29450
H          4.03101        1.19209       -1.60044
C          4.54891        3.21538       -0.86118
H          5.56936        3.16117       -1.29094
H          4.14959        4.23540       -1.02999
H          2.75061        2.39699       -2.04059
C          4.36855        2.76756        0.61383
H          5.14489        2.03864        0.91414
H          4.29898        3.54990        1.39610
H          2.18828        2.79792        0.30303
P         -0.09766       -1.75478       -0.75019
C          1.52498       -2.23565       -1.51703
C          1.99802       -1.34803       -2.70765
H          3.04330       -0.99867       -2.59182
C          1.84571       -2.56526       -3.65930
H          2.72470       -2.80646       -4.28806
H          0.96194       -2.48522       -4.32239
H          1.37746       -0.45942       -2.93721
H          2.22457       -2.26308       -0.66298
C          1.60526       -3.49056       -2.43788
H          2.47641       -4.12845       -2.18793
H          0.71335       -4.14910       -2.48122
C         -0.43919       -3.21154        0.34723
C          0.11443       -3.15373        1.79925
H          1.02189       -3.75160        2.01322
H          0.30364       -2.10614        2.10940
C         -1.24288       -3.69746        2.31600
H         -1.20745       -4.78099        2.54615
H         -1.68846       -3.17399        3.18575
H         -0.09917       -4.12055       -0.19287
C         -1.87169       -3.40183        0.92915
H         -2.48263       -4.19958        0.46337
H         -2.46192       -2.46731        0.91965
C         -1.29309       -2.00660       -2.15202
C         -1.45426       -0.89230       -3.22449
H         -1.25019        0.11103       -2.80301
C         -2.97205       -1.20236       -3.27246
H         -3.65525       -0.33102       -3.26956
H         -3.24003       -1.86529       -4.11973
H         -0.87097       -1.00614       -4.15997
C         -2.83452       -1.97223       -1.93297
H         -3.12828       -1.34653       -1.07187
H         -3.33639       -2.95600       -1.84554
H         -1.00881       -2.96807       -2.62923
H          0.46202        1.50900       -2.10067

