%nprocshared=24
%mem=41GB
%chk=ZZt.chk
#p opt=(modredundant,loose) b3lyp genecp scrf=(solvent=dichloromethane,pcm) nosymm empiricaldispersion=gd3 scf=maxcyc=512

Loose preopt

1 1
 P                  0.68901214    0.09688100   -3.22701283
 Au                 0.61429515   -0.31895990   -0.90559843
 C                 -0.21083309    1.61745481   -3.72545933
 H                  0.22237015    2.48173049   -3.21414685
 H                 -0.13757889    1.76088043   -4.80827842
 H                 -1.26294890    1.53017539   -3.43954910
 C                 -0.04629163   -1.23735928   -4.25200484
 H                 -1.09303851   -1.38011463   -3.96973747
 H                  0.01141344   -0.97382024   -5.31311117
 H                  0.49602646   -2.17129805   -4.07958935
 C                  2.38426119    0.31706932   -3.89623292
 H                  2.96914487   -0.58909387   -3.71483771
 H                  2.34282101    0.51428034   -4.97244802
 H                  2.86999588    1.15659745   -3.39095649
 C                  0.55794454   -0.56894864    1.12829417
 C                 -0.75790117   -0.42747120    1.86431283
 H                 -1.04264198   -1.41851896    2.22764316
 C                  1.67473724   -0.93468149    1.92124412
 H                  2.66715526   -0.70203847    1.54354037
 H                  1.75963982   -1.96824364    2.25494014
 C                 -1.87241836    0.00923941    0.90706111
 C                 -1.95937263    1.29282184    0.35014087
 C                 -2.81386775   -0.95999247    0.52819028
 C                 -2.98229004    1.60209776   -0.54827349
 H                 -1.25072465    2.06592998    0.61935995
 C                 -3.83402383   -0.64930109   -0.37228481
 H                 -2.75232094   -1.96139945    0.94640232
 C                 -3.92134074    0.63477030   -0.91377033
 H                 -3.04088069    2.60408578   -0.96326394
 H                 -4.55847866   -1.41075380   -0.64649563
 H                 -4.71315990    0.88001847   -1.61552520
 C                  1.36958095   -0.21961901    3.85263980
 C                  1.47657338    1.23683977    3.48727170
 N                  0.04976112   -0.35639222    4.20019659
 H                  2.13960183   -0.73122644    4.41622773
 O                  0.22855732    1.57383780    3.03472051
 O                  2.41326427    1.98545566    3.49472941
 C                 -0.50419021   -1.62855462    4.61709861
 H                 -0.41880864   -2.36719665    3.79836820
 H                  0.05362817   -1.99680164    5.47964641
 H                 -1.55423292   -1.49881021    4.88494594
 C                 -0.63388444    0.44084507    3.17931728
 H                 -1.61448271    0.78936992    3.50208743

16 42 F
18 32 F

-C -H -P -N -O 0
6-31G(d)
****
Au 0
SDD
****

Au 0
SDD

--link1--
%nprocshared=24
%mem=41GB
%chk=ZZt.chk
#p opt=(modredundant,calcfc,ts,noeigentest,maxstep=10) freq b3lyp genecp scrf=(solvent=dichloromethane,pcm) nosymm guess=read empiricaldispersion=gd3 geom=checkpoint scf=maxcyc=512

Opt freq

1 1

16 42 A
18 32 A

-C -H -P -N -O 0
6-31G(d)
****
Au 0
SDD
****

Au 0
SDD



