%nprocshared=12
%mem=4GB
# opt freq=noraman b3lyp/genecp scrf=(smd,solvent=dichloromethane)
empiricaldispersion=gd3

Enyne coord to Au through alkene

1 1
 C                  3.89864500    2.64680100   -0.25554900
 C                  5.13987900    3.27939100   -0.90594200
 H                  5.58309200    2.60880600   -1.64411900
 H                  4.85164600    4.20484500   -1.41147100
 H                  5.88600400    3.51197000   -0.14253700
 O                  4.27399500    1.47382900    0.53669200
 C                  2.79627300    2.33725200   -1.30344000
 H                  2.31054500    3.28846200   -1.54433200
 H                  3.26672500    1.99383500   -2.22808800
 C                  1.73526700    1.29942700   -0.88553100
 H                  1.08435100    1.15688500   -1.75459300
 H                  2.20923000    0.33619100   -0.68698800
 C                  0.89427400    1.75389200    0.28582600
 H                  0.36251200    2.69004400    0.12031100
 C                  0.97431500    1.32327000    1.59895600
 C                  1.86306800    0.20550200    2.07692900
 H                  2.20302000   -0.45013500    1.27562900
 H                  2.74574800    0.64714800    2.55328600
 H                  1.34527100   -0.39614000    2.83032200
 C                  0.34800200    2.15012500    2.69541500
 H                  1.15171400    2.68681200    3.21694900
 H                 -0.36046800    2.88466600    2.30518600
 H                 -0.15642000    1.52184000    3.43564800
 C                  3.38223100    3.57037700    0.77202600
 C                  2.98374100    4.37139900    1.58324000
 H                  2.62919000    5.07782900    2.30276200
 C                  4.86732300    0.35047700    0.07027600
 C                  5.29991000   -0.52364900    1.09015600
 C                  5.04489900   -0.01550700   -1.27633100
 C                  5.88882500   -1.73594100    0.78019800
 H                  5.16104600   -0.22168600    2.12202500
 C                  5.64114700   -1.23254900   -1.58832600
 H                  4.72621300    0.62588500   -2.08382800
 C                  6.05715000   -2.08435500   -0.56524400
 H                  6.22160500   -2.40929900    1.56012700
 H                  5.78104800   -1.52357700   -2.62203100
 N                  6.67435100   -3.35750600   -0.90190400
 O                  7.02064900   -4.10111200    0.02248500
 O                  6.82351100   -3.63933900   -2.09599900
 Au                -0.90444900    0.29060400    0.44417700
 P                 -2.64778400   -1.27983600    0.32383700
 C                 -1.88517400   -2.89722500   -0.36468700
 C                 -3.38207300   -1.43546900    2.07455000
 C                 -4.05068400   -0.81653700   -0.78391300
 C                 -0.43741700   -3.02676500    0.16249200
 C                 -2.64653000   -4.18365300    0.00099000
 C                 -1.82608500   -2.73077700   -1.89689500
 C                 -2.29049700   -1.97679300    3.01559000
 C                 -3.76905000   -0.00496100    2.50620000
 C                 -4.63499600   -2.32489500    2.16115400
 C                 -4.17193200    0.44470200   -1.41563100
 C                 -5.04453300   -1.78677700   -1.02503800
 H                 -0.02199700   -3.97338300   -0.20170000
 H                  0.20157600   -2.21899800   -0.20696100
 H                 -0.38010700   -3.03586500    1.25315300
 H                 -2.14200200   -5.02853000   -0.48234600
 H                 -2.63982900   -4.37108600    1.07711200
 H                 -3.67992600   -4.18573100   -0.34900400
 H                 -2.81750700   -2.74594900   -2.35555100
 H                 -1.32803800   -1.79697700   -2.18292200
 H                 -1.24546700   -3.55978500   -2.31735200
 H                 -1.36783500   -1.39068300    2.95150100
 H                 -2.65432500   -1.91600900    4.04775700
 H                 -2.05588800   -3.02399900    2.81011200
 H                 -2.90126100    0.66039800    2.55538800
 H                 -4.50791200    0.43772600    1.83142600
 H                 -4.21580000   -0.05029900    3.50618400
 H                 -4.45459900   -3.34802600    1.82743900
 H                 -4.94878400   -2.36998100    3.21055000
 H                 -5.46875900   -1.91140100    1.58909800
 C                 -5.27509400    0.67729600   -2.25661500
 C                 -3.21487300    1.58903300   -1.28604200
 C                 -6.13054000   -1.53636800   -1.85887200
 H                 -4.97212300   -2.75905600   -0.55807900
 C                 -6.24760500   -0.29333500   -2.47998500
 H                 -5.36079600    1.64659700   -2.73842900
 C                 -2.26669700    1.82180700   -2.29590700
 C                 -3.33424400    2.51661200   -0.23884000
 H                 -6.87531000   -2.30975400   -2.01989000
 H                 -7.08783100   -0.07885100   -3.13373300
 C                 -1.44900700    2.95371500   -2.25506100
 H                 -2.18058700    1.11662900   -3.11764000
 C                 -2.51822400    3.65008800   -0.20180900
 H                 -4.07425400    2.35346600    0.53799900
 C                 -1.57684400    3.87357400   -1.21077000
 H                 -0.72159700    3.12128900   -3.04415800
 H                 -2.62624200    4.36435300    0.60951000
 H                 -0.94939700    4.75981200   -1.18477200

-C -H -O -P -N -F
6-31G(d,p)
****
-Au
LanL2DZ
****

-Au
LanL2DZ
















