%mem=23300MB
%nproc=12
#p M06/GENecp Temperature=323 opt=(maxstep=3) nosymm freq=noraman scf=(maxcycle=500,xqc) scrf=(smd,solvent=n,n-DiMethylFormamide)

Triad project-ALM

0 1
 47       3.395675      11.066031       3.298063
 53       4.111445      13.465549       4.230602
 6       3.070323       7.992122       2.392588
 8       2.639348       9.156112       2.539510
 1       2.373903       7.204418       2.085431
 7       4.322045       7.590673       2.566446
 6       4.684522       6.189203       2.393113
 1       5.430924       6.093491       1.599710
 1       5.098153       5.794728       3.325466
 1       3.799010       5.610370       2.124490
 6       5.371603       8.520448       2.962655
 1       6.328498       8.000174       2.922867
 1       5.412417       9.371134       2.275523
 1       5.211218       8.881409       3.984280

-Cu -Ag -Au  -I
SDD
****
-C -H -P -F -S -O -N -Br
6-31+G(d,p)
****

-Cu -Ag -Au -I
SDD



