! Main indata file for fdmnes
! Calculation on Pt13 cubic using the multiple scattering approach with convolution.
! Calculation on both sites done in one run.

 Filout
  Sim/Test_stand/Pt13

 Range
  -5. 0.2  0. 0.5 10. 1. 20. 2. 40. 

 Radius
   4.0

 Green
 Relativism

 Edge
  L3

 Rmtg
  1.7

 Center_abs
 One_run

 Molecule
       1          1          1          90 90 90

  78   1.961950   1.961950   0.000000   !    2.774616  13     4   1   1  0.00000
  78   1.961950   0.000000   1.961950   !    2.774616  12     3   1   1  0.00000 
  78  -1.961950   0.000000   1.961950   !    2.774616   3     3   1   1  0.00000
  78  -1.961950   1.961950   0.000000   !    2.774616   4     4   1   1  0.00000
  78   0.000000  -1.961950  -1.961950   !    2.774616   5     2   1   1  0.00000
  78   0.000000  -1.961950   1.961950   !    2.774616   6     2   1   1  0.00000
  78   1.961950  -1.961950   0.000000   !    2.774616   7     4   1   1  0.00000
  78   0.000000   1.961950  -1.961950   !    2.774616   8     2   1   1  0.00000
  78   1.961950   0.000000  -1.961950   !    2.774616   9     3   1   1  0.00000
  78  -1.961950  -1.961950   0.000000   !    2.774616  10     4   1   1  0.00000
  78   0.000000   1.961950   1.961950   !    2.774616  11     2   1   1  0.00000
  78  -1.961950   0.000000  -1.961950   !    2.774616   2     3   1   1  0.00000
  78   0.000000   0.000000   0.000000   !    0.000000   1     1   1   1  0.00000

! keywords for the convolution
 Convolution

 Estart
   -20
 
 End

