# Poscar file from str.out              
   1.00000000000000     
     6.7129782882637521    5.7584718336297716   -6.0294983712284740
     8.3434717614987051    2.9343741346158834   -6.0294983698268103
    -9.9403004083324618   -5.7390354325021891   -5.8637856229325491
   Ti   Mo   S 
     3     4    14
Direct
  0.9999939697407134  0.9999939697407063 -0.0000021922271563
  0.7136217162648170  0.7136217162789800  0.5766070049921849
  0.2863724601510865  0.2863724601369661  0.4233824885838633
  0.8629841686356212  0.8629841685280116  0.2674942684960593
  0.1370084915305581  0.1370084916381961  0.7324925511950087
  0.4237376213190606  0.4237376214209352  0.1610644259186665
  0.5762540169129136  0.5762540168110319  0.8389228842171902
  0.0144399328497435  0.0144394328483518  0.6889497388134830
  0.4021881678677853  0.4021886678857752  0.4294785100666324
  0.1702565112783455  0.1702560112852752  0.4215224336434166
  0.5433684988267928  0.5433689988015298  0.1538030800196212
  0.3014687181038564  0.3014682181032167  0.1187571437645700
  0.6985262533025516  0.6985267533026583  0.8812339027040633
  0.5978061542285291  0.5978056542100346  0.5705122604344951
  0.9855541054201996  0.9855546054215558  0.3110409330881067
  0.7419459749632266  0.7419454749876069  0.2714480181056965
  0.1152514988743405  0.1152519988875132  0.0011439150090964
  0.8847392586195283  0.8847387586058725  0.9988431452782577
  0.2580476231072857  0.2580481230828911  0.7285413927911299
  0.4566277264743271  0.4566272265000591  0.8461918881551050
  0.8297371315289866  0.8297376315225827  0.5784672069505259
 
  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
