%nproc=20
%Mem=40000MB
%Chk=AC01-Br-TS1-2-5exo_more
#p SCRF=(PCM,Solvent=Dichloromethane) B3LYP/genecp opt EmpiricalDispersion=GD3 freq=noraman nosymm
# scf(maxcyc=100) gfinput gfprint

opt freq

1 1
 C                  2.55734700    0.83736700   -1.05033400
 C                  1.70225600    0.22632600   -0.10863900
 C                  1.99696700   -1.05526600    0.40251600
 C                  3.95142000   -1.14429900   -1.01502400
 H                  1.33649000   -1.50203300    1.13863400
 H                  4.83254500   -1.67232500   -1.36698500
 C                  0.52354300    0.92825500    0.29067100
 C                 -0.71336800    0.99716200    0.62086800
 C                  2.21951600    2.24925600   -1.48657400
 H                  1.60740700    2.20602200   -2.39616300
 H                  3.14014800    2.77955300   -1.75854800
 C                  1.45232600    3.00844700   -0.41827600
 H                  0.50901900    3.45733700   -0.71892900
 C                  1.94095400    3.32583800    0.81665900
 C                  3.28133500    2.87011200    1.32359100
 H                  3.88684700    3.74601700    1.59051300
 H                  3.15777400    2.28524000    2.24470600
 H                  3.84420200    2.26936400    0.60858000
 C                  1.17252300    4.20243400    1.76662900
 H                  0.91057500    3.65137800    2.67896800
 H                  1.80199900    5.04562500    2.07924900
 H                  0.25363600    4.59330600    1.32528000
 P                 -2.65834300   -2.94930100   -0.07923000
 C                 -4.13052700   -3.19404800    0.98518100
 H                 -4.59671900   -4.15930000    0.76257600
 H                 -3.82862000   -3.16728700    2.03570700
 H                 -4.85012300   -2.39096700    0.80314600
 C                 -1.57446700   -4.39246600    0.24768500
 H                 -2.12194500   -5.32355300    0.06733900
 H                 -0.70306000   -4.34748400   -0.41128000
 H                 -1.23454600   -4.36418900    1.28655600
 C                 -3.25754700   -3.16918600   -1.79765600
 H                 -3.96740300   -2.37377200   -2.04021600
 H                 -2.41171900   -3.11037300   -2.48796700
 H                 -3.74884100   -4.14187400   -1.90331700
 Au                -1.59445600   -0.91498800    0.27272100
 C                  3.11521900   -1.73922700   -0.06362700
 H                  3.34208700   -2.72792900    0.32253200
 C                  3.67589900    0.13971800   -1.49743000
 H                  4.34730400    0.60748600   -2.21225900
 Br                -1.81360700    2.38413300    1.24837300

C H P 0
6-31G*
****
Br 0
LANL2DZ
D 1 1.0
0.428 1.0
****
Au 0
SDD 
****

Br 0
LANL2DZ
Au 0
SDD




