# Poscar file from str.out              
   1.00000000000000     
     1.6545780008795687   -2.9131804680492150   -5.8928343082980330
    -4.9865413875484377    2.8977612894449880   -5.8905202658380693
     3.3269163397397512    5.8178375570712593   -5.8822554790320805
   Ti   Mo   S 
     3     4    14
Direct
  0.5498141134654930  0.2698128425894484  0.1700232387781326
  0.4398281345271138  0.6989995284207433  0.8472985472148740
  0.1365841954615075  0.5951148962459994  0.2656561659181612
  0.8900334598160238  0.4025464500476984  0.7131169203583988
  0.0096133235828819  0.0398445715548546  0.9594087775381447
  0.7266910749980637  0.8244118535923342  0.4478497971110912
  0.2466860890272159  0.1600556189580971  0.6018049624450399
  0.3347129605909947  0.8430154836983512  0.5847594307442363
  0.2441781145590180  0.4621585194581994  0.5582414017741566
  0.4877036647849259  0.3987920495540569  0.8686400008594040
  0.3851189505690441  0.0266115293519689  0.8460856767151935
  0.0513012222471075  0.7028491706455124  0.0030668230458566
  0.9540054108885588  0.3160887824369504  0.9878311313964303
  0.1840052618057546  0.2645570430705550  0.3063458911211520
  0.0907391927163450  0.8881874755762275  0.2648433276462887
  0.7657406023955117  0.5381391977769948  0.4376792012494607
  0.6510220346887066  0.1558748578288305  0.4258237051095921
  0.8850260842319275  0.1146645876067897  0.7199799046867753
  0.8148051849539235  0.7313156450002857  0.7091283402412270
  0.6363334387055962  0.9766190636925858  0.1542044980191344
  0.5159174859840433  0.5902708328935725  0.1281772580274309
 
  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
  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
