# Poscar file from str.out              
   1.00000000000000     
    -1.6911133828579059   -8.7936154167230765    0.0021420602176376
     6.7699371911708992    5.8613549470725994    0.0021420595600358
     0.0036097208790782   -0.0020840734499263    5.7548559922182321
   Mo   S    Ti
     1    10     4
Direct
  0.5999986138507847  0.3999986138507817  0.0000233328025593
  0.5330055204292318  0.1324750339573936  0.2502233111529273
  0.8675243367054708  0.4669942629239857  0.7497942598494800
  0.3324749339569673  0.3330056204289174  0.2502233111529584
  0.6669943629236770  0.6675242367050453  0.7497942598495112
  0.7332129127310216  0.9324540695980184  0.2448338013196752
  0.0675459684011074  0.2667875727379797  0.7551818815883063
  0.1324539695978762  0.5332130127309437  0.2448338013196792
  0.4667876727378934  0.8675458684009599  0.7551818815883102
  0.9356140921838114  0.7356141921835750  0.2505799091636558
  0.2643871063154937  0.0643870063157242  0.7494343203869078
  0.4013957067435055  0.5986056951746834  0.0000176246080164
  0.7986056951742656  0.2013957067430963  0.0000176246080373
  0.1993367957680436  0.8006623124804555  0.0000178403050096
  0.0006623124808506 -0.0006632042315669  0.0000178403049858
 
  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
