# Poscar file from str.out              
   1.00000000000000     
     1.6184813888843856    8.4885128055700889    0.0006541479138157
    -1.6184813888843856    8.4885128055700889    0.0006541479138157
     0.0000000000000000   -5.6579920659942742   12.2880264422340861
   Mo   S    Ti
     3    12     3
Direct
  0.1901557603869118  0.1901557603869118  0.2527419621545086
  0.5367399115645944  0.5367399115645944  0.2529471250933438
  0.1382264136133844  0.1382264136133844  0.7505479186446883
  0.3210198595311094  0.3210198595311094  0.6276919401738811
  0.6842119260184757  0.6842119260184757  0.3814236815300127
  0.5984863175533450  0.5984863175533450  0.1244919393923564
  0.4030010332299307  0.4030010332299307  0.8729771484024073
  0.6509398026789546  0.6509398026789546  0.6265606550242286
  0.0160916977637205  0.0160916977637205  0.3745138818570956
  0.9350812172917830  0.9350812172917830  0.1317522006129319
  0.7336439068446449  0.7336439068446449  0.8743578253461632
  0.9868051990348394  0.9868051990348394  0.6259130139652442
  0.3445050566696673  0.3445050566696673  0.3757905029247000
  0.2624278177670440  0.2624278177670440  0.1298374797867961
  0.0697103874687757  0.0697103874687757  0.8748280017867981
  0.8050406678635895  0.8050406678635895  0.7504476524233759
  0.8583878938419685  0.8583878938419685  0.2530639173568434
  0.4755251308772595  0.4755251308772595  0.7501131535245761
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
