%nproc=24
%mem=122000MB
%chk=dmf_dosmet240.chk
#p ub3lyp/gen scrf=(pcm,solvent=n,n-DiMethylFormamide) pseudo=(read) 

title

0 3
 P                  1.30891800    2.06709700   -0.00184400
 C                 -4.28450800   -0.99932300   -0.00474700
 Br                -1.85277900    0.16527000    0.00130800
 Pd                 0.65980300   -0.17877900    0.00175900
 P                  2.64026100   -1.47111500   -0.00128300
 H                 -4.40472700   -1.08583300    1.06834500
 H                 -4.80789500   -0.20214500   -0.51902000
 H                 -4.02007400   -1.88720600   -0.56600000
 C                  3.07597627    2.50005348    0.04769141
 H                  3.56671309    2.09489003   -0.81249458
 H                  3.18238177    3.56474573    0.05057057
 H                  3.51770843    2.09506491    0.93412074
 C                  0.74624164    3.16344041    1.33749406
 H                  1.38991281    4.01628379    1.39446406
 H                 -0.25479980    3.48476517    1.13858096
 H                  0.77280782    2.63382550    2.26684991
 C                  0.83249100    3.12620971   -1.40316394
 H                  1.43807830    4.00834248   -1.40557086
 H                  0.97664306    2.59212338   -2.31906349
 H                 -0.19734547    3.40082817   -1.30871005
 C                  4.24384787   -0.63041351    0.18346054
 H                  4.40911002    0.01113371   -0.65678084
 H                  4.24007503   -0.04838608    1.08130787
 H                  5.02512628   -1.35972986    0.23446751
 C                  2.90851322   -2.76182551    1.25351066
 H                  2.10988454   -3.47262468    1.21042047
 H                  3.83754967   -3.25718148    1.06268686
 H                  2.93581409   -2.31449431    2.22513274
 C                  3.06771537   -2.47067110   -1.46093034
 H                  4.00826498   -2.95443156   -1.29893573
 H                  2.31004546   -3.20882981   -1.62204530
 H                  3.13614115   -1.83640277   -2.31995397

-C -F -H -P -Br 0
6-31+G(d,p)
****
-Pd 0
SDD
****

-Pd 0
SDD

--link1--
%nproc=24
%mem=122000MB
%chk=dmf_dosmet240.chk
#p ub3lyp/gen guess=(read,mix) scrf=(pcm,solvent=n,n-DiMethylFormamide) geom=checkpoint opt=(maxcyc=300,maxstep=2,ts,calcfc,noeigentest) freq pseudo=(read)                  

title

0 1

-C -F -H -P -Br 0
6-31+G(d,p)
****
-Pd 0
SDD
****

-Pd 0
SDD



