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

Title Card Required

0 1
Pd         0.13683       -0.24541        0.43858
O          0.04955       -1.20800        2.25801
H         -0.89952       -1.39853        2.38648
O          1.06240        0.80214        3.60457
C         -1.87227       -0.56481        0.23281
C         -2.33491       -1.60702       -0.56992
C         -2.84299        0.26255        0.87938
C         -4.20355        0.07033        0.68735
C         -4.68814       -0.96560       -0.16303
C         -3.72682       -1.83445       -0.79671
C         -4.20133       -2.87662       -1.64772
C         -5.55921       -3.05167       -1.87288
C         -6.50575       -2.19199       -1.25099
C         -6.07613       -1.17294       -0.41269
H         -2.51575        1.08934        1.52865
H         -4.93148        0.73214        1.18393
H         -1.62768       -2.28363       -1.07968
H         -7.58083       -2.33980       -1.43531
H         -6.80503       -0.50545        0.07410
H         -3.46539       -3.54187       -2.12775
H         -5.90874       -3.85953       -2.53413
H          0.59386        0.01847        3.14113
P          2.50247       -0.21271        0.70558
C          3.48505       -0.65432       -0.80332
C          3.45326       -1.95877       -1.38021
C          4.21012       -2.20470       -2.54741
H          4.17933       -3.21504       -2.98329
C          4.97387       -1.20162       -3.15836
H          5.54285       -1.42268       -4.07400
C          5.01025        0.07793       -2.58862
H          5.61526        0.87654       -3.04402
C          2.70751       -3.10414       -0.78165
C          1.31110       -3.07226       -0.59246
H          0.74238       -2.17342       -0.88422
C          0.64214       -4.15106        0.00223
H         -0.44355       -4.08561        0.16832
C          1.35628       -5.29209        0.39682
H          0.83256       -6.13657        0.86984
C          2.74449       -5.34936        0.18911
H          3.31298       -6.24037        0.49665
C          3.41406       -4.26559       -0.39632
H          4.50565       -4.30059       -0.53569
C          4.27826        0.33824       -1.42102
H          4.33852        1.34064       -0.97427
C          3.06026       -1.38432        2.00880
C          3.23364        1.36347        1.30460
P         -0.01888        0.92086       -1.49354
C         -1.60382        1.85490       -1.65380
C         -1.83259        3.06645       -0.94351
C         -3.08497        3.70349       -1.08349
H         -3.25619        4.64194       -0.53430
C         -4.10869        3.14829       -1.86119
H         -5.08317        3.65501       -1.93007
C         -3.88847        1.93874       -2.53383
H         -4.68753        1.47519       -3.13117
C         -0.82655        3.70071       -0.04090
C         -0.37968        5.01717       -0.29176
H         -0.75535        5.55166       -1.17819
C          0.54889        5.63229        0.56137
H          0.89609        6.65398        0.34268
C          1.03256        4.94949        1.69068
H          1.75703        5.43716        2.36116
C          0.58217        3.64805        1.96330
H          0.92293        3.07849        2.84211
C         -0.33589        3.03147        1.10068
H         -0.66209        2.00389        1.32380
C         -2.64135        1.30878       -2.43744
H         -2.49019        0.35805       -2.96563
C          0.03481       -0.17284       -2.97600
C          1.27694        2.15960       -1.92721
H         -0.71142       -0.98279       -2.87611
H          1.04309       -0.63246       -3.00114
H         -0.14260        0.39111       -3.91309
H          0.97516        2.71967       -2.83385
H          2.22035        1.61646       -2.12453
H          1.42506        2.86845       -1.09338
H          2.95718        2.21406        0.65491
H          4.33473        1.29928        1.41323
H          2.74990        1.50737        2.29330
H          4.16598       -1.42084        2.05711
H          2.63815       -2.38790        1.82812
H          2.63245       -0.98286        2.94752
H          1.08248        0.53324        4.53974

