%nprocs=48
%mem=350GB
%chk=3t-tbujohnphos-6cne13-ts-etrxt-et1.chk
# PBEPBE/def2SVP/W06 int=(grid=ultrafine)
# opt=(calcfc,ts,noeigentest) empiricaldispersion=GD3BJ 
# symmetry=none freq=noraman

Title Card Required

0 1
Pd        -0.01012       -0.01213        0.22424
O         -0.94560       -0.26241        1.93103
H         -1.47003        0.55777        2.06150
H          2.44911       -3.56117       -0.03892
H          3.81324       -1.87120       -3.05528
H          2.46070       -2.32967       -1.96258
C          3.56407       -2.31298       -2.07018
C          3.21558       -3.23261        0.68711
H          2.78928       -3.35092        1.70329
H          4.09480       -3.90323        0.60357
H          3.91792       -3.36333       -2.05843
H          3.97748       -1.34755        2.55430
C          3.61215       -1.77365        0.46423
C          4.21549       -1.45941       -0.96686
C          4.53768       -1.30615        1.59938
H          4.86339       -0.25991        1.44167
O          1.41811        0.39060       -1.27571
O          3.85960       -0.08554       -1.17353
H          1.51222       -0.28030       -1.97956
H          6.23603       -0.87003       -0.38094
B          2.70018        0.22242       -0.36771
C          5.73692       -1.58787       -1.05702
O          2.43077       -0.96073        0.46667
H          5.43647       -1.94714        1.69601
H          6.07009       -2.61422       -0.80045
H          6.07069       -1.36579       -2.09032
P         -1.80355       -0.82196       -0.85842
C         -2.07811       -2.62327       -0.19508
C         -3.40212        0.08648       -0.60961
C         -1.53724       -0.79804       -2.76546
C         -0.38051       -1.75709       -3.10413
C         -1.17230        0.65235       -3.13765
C         -2.77541       -1.18958       -3.59174
C         -2.90547       -2.51243        1.09852
C         -0.67975       -3.17900        0.14833
C         -2.76167       -3.59677       -1.17167
H         -3.60471       -0.46937       -3.46254
H         -3.14675       -2.20670       -3.37329
H         -2.48602       -1.16872       -4.66389
H         -0.70123       -2.81595       -3.09226
H          0.46639       -1.67247       -2.39729
H         -0.00274       -1.53611       -4.12384
H         -0.98867        0.70220       -4.23164
H         -0.26419        1.01090       -2.61789
H         -2.01190        1.34125       -2.91481
H         -0.01904       -3.24535       -0.73687
H         -0.80065       -4.20545        0.55473
H         -0.16734       -2.56110        0.90987
H         -2.18626       -3.75643       -2.10280
H         -3.79476       -3.30457       -1.43821
H         -2.83498       -4.58177       -0.66454
H         -2.91652       -3.50809        1.59007
H         -3.95436       -2.21846        0.90228
H         -2.43832       -1.77924        1.78662
C         -3.55682        1.34771        0.03888
C         -4.86691        1.87307        0.17375
C         -5.99813        1.20448       -0.29992
C         -5.84622       -0.03952       -0.92631
C         -4.56444       -0.57948       -1.07027
C         -2.47539        2.17626        0.64192
H         -4.97761        2.85379        0.65932
H         -4.47030       -1.56151       -1.54685
H         -6.99490        1.65483       -0.17973
H         -6.71909       -0.59401       -1.30166
C         -2.60885        2.57510        1.99312
C         -1.66518        3.42538        2.58940
C         -0.57884        3.90334        1.84246
C         -0.42595        3.50606        0.50568
C         -1.36069        2.64383       -0.08951
H          0.15260        4.58071        2.30442
H          0.43687        3.85848       -0.07806
H         -3.46411        2.20535        2.57986
H         -1.78003        3.71768        3.64389
H         -1.25436        2.37971       -1.14809
C          2.77498        1.59415        0.48478
C          2.38261        1.60651        1.82354
C          3.23136        2.82052       -0.09268
C          3.28467        3.99523        0.63993
C          2.86724        4.01985        2.00670
C          2.40599        2.79311        2.61068
C          1.96899        2.81542        3.96767
C          1.96959        3.98636        4.70471
C          2.42471        5.20607        4.10642
C          2.87064        5.21106        2.77900
H          3.55832        2.81832       -1.14461
H          3.64684        4.93018        0.18269
H          2.05607        0.66551        2.29672
H          3.22002        6.15017        2.32441
H          1.61258        1.87659        4.41880
H          1.62410        3.99892        5.74811
C          2.41748        6.41941        4.86969
N          2.40381        7.41037        5.50068

