CCL: pop=readradii



 Sent to CCL by: "Saied Mohammed Soliman" [saied1soliman*o*yahoo.com]
 Hello,
 When running the input file below, the VDW radii of Pt is not defined so
 by adding the pop=readradii with last line contain the Pt radii, it
 should work but it gave the same error "No vdW radius available for IA=
 78". Is there any error in the input?
 %mem=100MW
 # opt freq=internalmodes wb97xd/lanl2dz geom=connectivity pop=readradii
 Title
 0 1
  Pt                 2.40309040    4.70422107    2.62073180
  N                  0.88603979    3.42389665    2.76011206
  N                  1.89266617    6.20971462    1.42362851
  Cl                 4.22413936    3.63425185    1.76204293
  Cl                 2.90497743    5.51620755    4.69128422
  H                  1.05610682    2.59881841    3.29892845
  H                  0.79020441    3.06365560    1.83454816
  H                  0.28272729    3.38359381    1.96637642
  H                  2.24948442    5.85965083    0.54965725
  H                  1.73478842    6.11981340    0.43333458
  H                  0.96422574    6.04761060    1.75787491
  1 2 1.0 3 1.0 5 1.0 4 1.0
  2 6 1.0 8 1.0 7 1.0
  3 11 1.0 10 1.0 9 1.0
  4
  5
  6
  7 8 1.0
  8
  9 10 1.0
  10
  11
 Pt 2.1
 Thanks
 Saied