%nproc=20
%Mem=40000MB
%Chk=IE10_TSEc_Ib
#p SCRF=(PCM,Solvent=Dichloromethane) B3LYP/genecp opt=(modredundant) EmpiricalDispersion=GD3 freq=noraman nosymm 
# scf(maxcyc=100) gfinput gfprint

opt freq

1 1
 C                  0.50404000   -0.92339200   -4.60702600
 H                  1.33636900   -0.61993800   -5.25829500
 H                 -0.38586800   -0.35789300   -4.91927400
 C                  0.87008000   -0.56946600   -3.15234000
 H                  1.56236300   -1.36638600   -2.84681100
 C                 -0.29592400   -0.61071900   -2.15747100
 C                 -1.48409700   -1.26947500   -2.51251900
 H                 -1.55300800   -1.74248200   -3.48387200
 C                 -2.56439800   -1.36986600   -1.63655400
 H                 -3.46569700   -1.88767600   -1.95254600
 C                 -2.47952100   -0.80875500   -0.36466000
 H                 -3.31244700   -0.87408900    0.32940800
 C                 -1.30867200   -0.15504200    0.01313800
 H                 -1.23376700    0.29055500    0.99795300
 C                 -0.21484800   -0.05637500   -0.85789800
 C                  2.29290900    0.44269400   -0.92172300
 C                  3.49644500    0.06435400   -0.85629400
 H                  4.32988800    0.04768200   -1.54437900
 Au                 3.78262700   -0.91868000    1.02445100
 P                  4.23831800   -2.01916900    3.01629400
 C                  3.00449900   -1.65526300    4.32443600
 H                  3.26423700   -2.18957100    5.24412800
 H                  2.01356100   -1.96960200    3.98553300
 H                  2.98528600   -0.57938600    4.51926700
 C                  5.86197300   -1.58099400    3.74781400
 H                  6.66010000   -1.85651000    3.05299600
 H                  6.00266500   -2.11217300    4.69470300
 H                  5.90444000   -0.50264600    3.92437700
 C                  4.25528400   -3.84674900    2.86749500
 H                  4.45368100   -4.30064300    3.84412900
 H                  5.03297000   -4.14789800    2.16019700
 H                  3.28628300   -4.19028700    2.49511100
 O                  1.04959800    0.66947000    1.06211100
 C                  1.61264100    1.81093400    1.71285900
 H                  2.65021100    1.98236200    1.39826000
 H                  1.01341700    2.70831900    1.51051400
 H                  1.59549100    1.58848500    2.78086200
 O                  0.28823100   -2.32897400   -4.69832200
 H                  0.02814800   -2.53157000   -5.61107800
 C                  0.96008700    0.78668000   -0.35184700
 H                  0.76549600    1.83932100   -0.60664100
 C                  1.33072600    2.01543900   -3.18930900
 C                  1.70581300    0.70260000   -3.17002500
 H                  2.74338500    0.51170900   -3.43089700
 C                 -0.13286022    2.36023409   -3.24478786
 H                 -0.34672978    2.94838867   -4.14760813
 H                 -0.77334238    1.47367506   -3.24513187
 H                 -0.39816251    2.99352375   -2.39001867
 C                  2.27703109    3.19097401   -3.15151991
 H                  1.85228505    4.02185697   -3.72897887
 H                  3.24076409    2.93611044   -3.59658435
 C                  2.56997816    3.69536182   -1.70190215
 H                  2.60391338    2.79898616   -1.06840357
 H                  1.71463280    4.28283075   -1.35964384
 C                  3.85987458    4.45182569   -1.54162755
 H                  4.75752824    3.83554665   -1.61622078
 C                  4.02420037    5.76921509   -1.33679981
 C                  5.40355428    6.36777550   -1.19301177
 H                  5.51192701    6.87183473   -0.22253627
 H                  6.19217697    5.61306594   -1.27622842
 H                  5.57874572    7.13374085   -1.96140802
 C                  2.90065338    6.77347971   -1.24900261
 H                  1.90740404    6.32755640   -1.33384516
 H                  2.94688646    7.32506164   -0.30028943
 H                  3.00008715    7.52080189   -2.04842191

16 43 F

C H P O 0
6-31G*
****
Au 0
SDD
****

Au 0
SDD

--link1--
%nproc=20
%Mem=40000MB
%Chk=IE10_TSEc_Ib
#p geom=checkpoint guess=read SCRF=(PCM,Solvent=Dichloromethane) B3LYP/genecp opt=(ts, noeigentest, calcfc, modredundant) EmpiricalDispersion=GD3 freq=noraman nosymm 
# scf(maxcyc=100) gfinput gfprint

opt freq

1 1

16 43 A

C H P O 0
6-31G*
****
Au 0
SDD
****

Au 0
SDD



