%chk=TpBrCF3_2Ag_CHCF3-2-F-C-F-C-F1.chk
%nproc=24
%mem=120GB
#p freq=NoRaman B3LYP gen pseudo=read empiricaldispersion=GD3 nosymm scf=xqc SCRF=(SMD,solvent=n-Hexane)

Ag Carbene - Alcane -- PROJECT

0 1
47             5.588064   -0.938535   10.240832
35             7.398195    1.952582    4.841810
35            -0.570504   -0.524770    9.403637
35             6.821436    3.597616   14.178490
 9             6.565167   -1.239842    5.246341
 9             6.076405   -2.019274    7.221852
 9             8.025395   -1.124025    6.852852
 9             6.256051    4.497038    6.187826
 9             5.953143    4.517593    8.342178
 9             4.249937    4.306966    7.003992
 9             1.111540   -2.662722   10.999716
 9             3.082691   -2.253726   11.833549
 9             2.899076   -2.978356    9.794728
 9            -0.002687    2.283337    8.288381
 9             1.982647    2.762638    7.541746
 9             1.337060    3.509967    9.481870
 9             7.023105   -0.465668   13.316687
 9             8.570149    1.062238   13.457057
 9             8.345752   -0.104669   11.631435
 9             4.522921    5.087493   12.794849
 9             3.084012    4.002409   11.578112
 9             4.656428    5.170416   10.628224
 6             6.191393   -2.866615   10.278050
 7             5.415796    0.421260    8.060685
 7             5.126790    1.723643    8.221306
 7             3.400958   -0.050903   10.217582
 7             3.140594    1.143427    9.663182
 7             6.050150    1.211301   10.959622
 7             5.185491    2.209604   10.710101
 6             6.168379    0.318005    6.970841
 6             6.388395    1.587637    6.397773
 6             5.701668    2.464207    7.232091
 6             6.708998   -1.018826    6.564490
 6             5.539215    3.955417    7.183812
 6             2.268152   -0.752995   10.220351
 6             1.228902    0.002934    9.644361
 6             1.832309    1.212955    9.301826
 6             2.322740   -2.167846   10.719296
 6             1.277208    2.450137    8.651162
 6             6.699929    1.510123   12.085273
 6             6.239277    2.736357   12.599755
 6             5.268670    3.150300   11.687467
 6             7.673093    0.506035   12.633016
 6             4.382011    4.366394   11.672944
 5             4.280158    2.182224    9.438831
 1             3.828283    3.253178    9.248112
 1             6.564660   -3.453659    9.431473
 6             5.973439   -3.797184   11.437708
 9             5.634314   -3.174599   12.574260
 9             4.964024   -4.628135   11.094121
 9             7.089052   -4.515608   11.677745

-Ag 0
LANL2DZ
F 1 1.000
1.611 1.000
****
-Br 0
LANL2DZ
P 1 1.000
0.03760 1.000
D 1 1.000
0.43400 1.000
****
-C N H B F 0
6-31G(d,p)
****

Ag Br 0
LANL2DZ









