#
#Single point
#
! wb97x-d3bj def2-TZVPPD def2/J defgrid3 verytightscf
%pal nprocs 8 end
%maxcore 4000
%cpcm smd true
smdsolvent "dichloromethane"
end

* xyz 1 1
  C          -1.13587029053099     -1.21212232338626      2.85950199135856
  H          -0.45807068044419     -1.71660517207908      2.16838840894797
  H          -1.50498349063101     -1.96327619562780      3.56227350157925
  C          -2.29702706038006     -0.69994579830933      2.11948949380922
  C          -3.33310324075520     -0.24141632207815      1.66630696173709
  H          -4.32745462478739      0.10700033575210      1.46392937869515
  C          -0.37834525875985      2.22997079665881      2.76626874693739
  H           0.00679180737169      3.03449469703722      2.14978436135414
  H          -1.18241486923734      2.47427362074173      3.45232327026835
  C           0.11974624861342      0.99540355581156      2.72263917892380
  C          -0.42164168184379     -0.08547987213961      3.62516966725243
  H           0.37955294289929     -0.53988800191117      4.21160481608339
  H          -1.12125624162867      0.36415098336217      4.33070641470291
  Au         -1.96436379240447     -0.15171206782049     -0.09322212249462
  P          -1.14721450763245      0.04725899571572     -2.22046831196842
  C          -2.36259893438988     -0.48473897693201     -3.44752170604703
  C          -0.70046760718289      1.73015985231982     -2.69522530073840
  C           0.30278012529275     -0.99277164629034     -2.49973822579725
  H           0.00275530350840     -2.03937049360071     -2.41955954902568
  H           0.70892936521660     -0.80348742599605     -3.49576995259459
  H           1.06244471658974     -0.78928935451990     -1.74707422636296
  H          -2.64269224265070     -1.52203995434282     -3.25759505041284
  H          -1.93324527848922     -0.39880442970786     -4.44855798578545
  H          -3.25181603052605      0.14394504266675     -3.37727640295571
  H          -1.59245908494533      2.35795890373553     -2.65189028373187
  H          -0.30495279636678      1.72846682098432     -3.71355164970625
  H           0.04810418083552      2.13040253920399     -2.01331715347567
  C           1.21724880986464      0.64475916783078      1.77751211383076
  C           2.11741300329824     -0.37764271341957      2.08085140763472
  C           1.35543656374151      1.34191600494628      0.57374289958628
  C           3.14506745720384     -0.66626975141926      1.20792486631551
  H           2.04876245281735     -0.95564817300280      2.99270252911529
  C           2.38609497048974      1.02906718259370     -0.28203105842591
  H           0.66420911413598      2.12350873473888      0.28893931123356
  C           3.29917407705204      0.02371379110010      0.01407535694624
  N           4.37043520487267     -0.31641100994752     -0.92061482019173
  O           5.49699620068602     -0.39766854051390     -0.47621842576059
  O           4.05818736806380     -0.49810690064466     -2.08119876917498
  F           2.52286489259464      1.71429744988679     -1.42484093038674
  F           3.99195595752846     -1.65932665877734      1.50220551507035
*

