%nprocshared=20 %mem=2GB #p opt freq=noraman b3lyp/genecp scrf=(smd,solvent=dichloroethane) empiricaldispersion=gd3 integral(grid=ultrafine) Title Card Required 0 1 Rh 0.00890000 0.00390900 1.22856500 O 1.42836900 1.51184500 1.14615400 O -1.41153500 -1.50430600 1.15143300 O -1.50008600 1.42219800 1.16894500 C 1.90481600 -1.78190100 -0.01636700 C 2.99000600 -2.88161300 -0.00345500 F 3.99156500 -2.53216600 0.81758300 F 2.44820200 -4.02722200 0.44956000 F 3.48910500 -3.09719800 -1.22414000 O 1.51734800 -1.41496000 1.12764500 O 1.50870300 -1.39050400 -1.14749900 Rh -0.00959500 0.01742200 -1.20371800 O 1.39740400 1.53612900 -1.12852600 O -1.52982500 1.42252700 -1.10614700 O -1.41471200 -1.50251900 -1.12361900 C 1.79254900 1.91498200 0.00885100 C -1.78970100 -1.89737000 0.01544300 C 2.89641900 2.99567800 -0.01978000 F 4.05006300 2.43231900 -0.42393100 F 3.08500300 3.53921700 1.18655500 F 2.57241200 3.96704400 -0.88552200 C -2.86098500 -3.01012900 -0.01710900 F -2.38798900 -4.07104400 -0.69173900 F -3.95725200 -2.55813200 -0.64991500 F -3.20582700 -3.40165300 1.21275500 C -1.90908300 1.79853200 0.03743600 C -3.02512300 2.86663600 0.01847000 F -4.09102400 2.39531500 -0.64931700 F -3.40671300 3.20599500 1.25299600 F -2.57948100 3.96618800 -0.61334400 C 0.25652215 0.59669239 3.77083935 H -0.79220392 0.65584576 4.06860208 C 0.95468952 -0.54200365 3.86265230 O 0.78779374 1.75014323 3.25245575 C 0.14447938 2.94524559 3.68795556 H 0.61218639 3.77217026 3.14823939 H -0.93028366 2.93244157 3.45750548 H 0.27328360 3.10318199 4.76745495 C 2.41727548 -0.65396710 3.50184465 C 0.31745578 -1.81090181 4.37931300 H 2.82098444 0.32328774 3.22170201 H 2.52315379 -1.31069733 2.62412102 H -0.71767638 -1.63086749 4.69254601 H 0.27844682 -2.55465315 3.56750707 C 3.22611616 -1.26566675 4.66502877 C 1.13832412 -2.41031433 5.53934729 C 2.61120876 -2.59046235 5.14095117 H 1.07793439 -1.73587453 6.40463995 H 0.70450952 -3.36925395 5.84878327 H 4.26755269 -1.41633959 4.35566821 H 3.24073026 -0.55381405 5.50179466 H 2.67623522 -3.32946512 4.32911432 H 3.18553970 -2.99552514 5.98310298 -Rh LanL2DZ **** -P -C -H -O -Cl -F 6-31G(d,p) **** -Rh LanL2DZ