%nprocs=48
%mem=350GB
%chk=3m-cyjohnphos-6cne01-ecrxt.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd         0.22942        0.47515       -1.50073
O          0.38406       -0.96205       -2.84777
H         -0.30319       -1.60679       -2.57699
H          2.00107        2.74889       -1.60885
H         -1.44872        6.45375       -1.19660
H         -0.20235        5.68445       -2.21890
C         -0.53619        5.82637       -1.17459
C          1.30865        3.61289       -1.60604
H          1.91406        4.54028       -1.58579
H          0.73884        3.59637       -2.55457
H          0.24690        6.38032       -0.61814
H          2.10231        3.04975        0.87358
C          0.38768        3.51912       -0.38479
C         -0.85966        4.48990       -0.50226
C          1.20000        3.69386        0.89655
H          0.60588        3.42185        1.78767
O         -1.37114        1.64059       -2.45302
O         -1.76116        3.76849       -1.33713
H         -1.02029        2.29018       -3.09285
H         -2.49856        5.24491        0.68252
B         -1.60492        2.34716       -1.12923
C         -1.52185        4.75534        0.86185
O         -0.27152        2.22353       -0.34409
H          1.54502        4.74200        1.00189
H         -1.71648        3.81534        1.41040
H         -0.90972        5.42095        1.50230
P          1.58521       -0.65278       -0.13740
H          1.22106        1.00521        4.55803
C          0.80893        0.29590        3.82483
H          2.13477        0.96165        2.26691
C          1.32338        0.26782        2.52134
C         -0.21513       -0.58916        4.18532
H         -0.61976       -0.58903        5.20874
C          0.82585       -0.62739        1.55010
C         -0.74268       -1.46178        3.22468
C         -0.26238       -1.48315        1.89873
H         -1.58013       -2.12591        3.48442
C         -0.93926       -2.40286        0.93764
C         -1.64997       -1.89546       -0.17084
H         -1.72974       -0.80858       -0.31273
C         -2.28542       -2.76495       -1.06982
H         -1.52935       -5.75258        0.43041
H         -0.40522       -4.20220        2.03522
C         -1.55950       -4.66679        0.25320
C         -0.93026       -3.79706        1.15657
C         -2.22744       -4.15392       -0.87070
H         -2.72202       -4.83645       -1.57822
H         -2.84657       -2.34288       -1.91771
H          5.40047        1.85380       -2.19126
H          3.01725        1.02153       -2.04175
H          4.17834       -0.30080       -1.86325
C          4.96001        1.61435       -1.20113
C          3.80450        0.61930       -1.37080
H          4.55860        2.57212       -0.79841
C          6.03626        1.07056       -0.25168
H          6.51948        0.18526       -0.72292
H          6.84013        1.82157       -0.10417
C          3.20342        0.26703        0.00607
H          2.86913        1.23245        0.44995
C          5.44167        0.65221        1.09952
C          4.27935       -0.33778        0.92522
H          4.66226       -1.27300        0.46405
H          5.07004        1.55488        1.63570
H          6.22408        0.20569        1.74809
H          3.85559       -0.62147        1.90967
H          2.85669       -5.39224        1.07235
H          1.80081       -3.16458        1.53812
H          3.45170       -2.97374        0.91363
C          2.46348       -4.78342        0.23106
C          2.42812       -3.30156        0.63566
H          1.42057       -5.12675        0.05219
C          3.29676       -5.00990       -1.03660
H          4.36378       -4.77629       -0.81861
H          3.26694       -6.07982       -1.33156
C          1.91019       -2.44882       -0.53730
H          0.89378       -2.80851       -0.80478
C          2.81432       -4.11884       -2.18760
C          2.79065       -2.63702       -1.78745
H          3.82999       -2.31054       -1.56578
H          1.78733       -4.42358       -2.48959
H          3.45598       -4.25501       -3.08310
H          2.38785       -2.01244       -2.60854
C         -2.75124        1.51868       -0.34239
C         -2.68274        1.26832        1.02834
C         -3.85828        0.96616       -1.06186
C         -4.82520        0.19186       -0.44034
C         -4.75739       -0.06844        0.96075
C         -3.66661        0.50201        1.71389
C         -3.60428        0.26049        3.11894
C         -4.54891       -0.52033        3.75888
C         -5.61985       -1.10570        3.00761
C         -5.71647       -0.87225        1.63195
H         -3.91535        1.14193       -2.14717
H         -5.65736       -0.24046       -1.01870
H         -1.81843        1.63749        1.60417
H         -6.54413       -1.31676        1.05937
H         -2.77899        0.71024        3.69071
H         -4.49513       -0.70094        4.84202
C         -6.58786       -1.92716        3.67256
N         -7.37354       -2.60273        4.22658

