%nprocshared=20
%mem=41GB
#p opt=maxstep=17 freq=noraman nosymm b3lyp genecp scrf=(pcm,solvent=dichloromethane) empiricaldispersion=gd3 scf=(xqc,maxcyc=1024)

opt freq

1 1
 Au                -0.90673739   -0.88732136    0.76397168
 C                 -0.13619843   -2.80810005   -0.12118376
 C                 -0.17576067   -2.10399289   -1.12909468
 C                  2.05465797   -0.25396041   -2.12267939
 H                  2.44914004   -1.27219355   -2.20379277
 H                  2.68454853    0.38149457   -2.75256550
 C                  2.11011074    0.23457187   -0.70180419
 H                  1.85399792    1.28265187   -0.55410541
 C                  2.43869940   -0.52097825    0.35786845
 C                 -0.21023433   -1.51962321   -2.47533809
 H                 -1.25046324   -1.33434316   -2.75496572
 H                  0.16400835   -2.31296603   -3.13528041
 C                  0.62294380   -0.23159949   -2.74589684
 O                 -0.47826895    0.04235373   -4.82417506
 O                  0.49467595    2.11834276   -2.66323046
 C                 -0.52664232    0.12631296   -6.26776910
 H                 -0.14760159   -0.79838206   -6.70892905
 H                 -1.57759753    0.27055164   -6.51349582
 H                  0.07315979    0.97149522   -6.61289736
 C                 -0.09074381    3.38008953   -2.26789259
 H                 -1.13590255    3.42572500   -2.58039486
 H                 -0.02069381    3.49660428   -1.18370131
 H                  0.50034054    4.14251656   -2.77252622
 P                 -1.72495537    0.78155719    2.14647995
 C                 -1.05465169    2.42344551    1.69054525
 C                 -3.54708690    0.95817015    2.07057363
 H                  0.01411242   -3.60236119    0.58424796
 C                  0.73633998   -0.13284906   -4.28429409
 C                 -0.13966949    1.01099794   -2.26664309
 O                 -1.15961110    1.00380548   -1.60422872
 O                  1.76374371   -0.22908817   -4.91656238
 H                  2.65071093   -1.57728358    0.19232239
 C                  2.46415520   -0.08867680    1.76068680
 C                  2.38857975   -1.05133424    2.77918969
 C                  2.52779428    1.26640695    2.14914073
 C                  2.35032681   -0.69874021    4.13053711
 H                  2.35058654   -2.10458561    2.51134060
 C                  2.49299155    1.63386250    3.48546790
 H                  2.62420564    2.04148339    1.39446904
 C                  2.39890987    0.65448066    4.49174802
 H                  2.28733342   -1.47747828    4.88123212
 H                  2.54820067    2.67657452    3.78222174
 C                 -1.32004131    0.54835109    3.91612312
 H                 -0.23515757    0.49307778    4.03283092
 H                 -1.71259433    1.38688470    4.50067257
 H                 -1.76453582   -0.38505501    4.27228136
 H                  0.03177733    2.41010396    1.80950825
 H                 -1.48612236    3.19830252    2.33254455
 H                 -1.30068931    2.62364981    0.64493871
 H                 -3.84917100    1.16576952    1.04030593
 H                 -3.86988735    1.77858262    2.71950587
 H                 -4.01766346    0.02681406    2.39725694
 H                  2.37134292    1.02307839    5.49587738

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

Au 0
SDD


