Ba   Ti   O    H 
   1.00000000000000     
   7.9566815237605697   0.0000000000000000   0.0000000000000000
   0.0000000000000000   8.0176791703248007   0.0073158968867547
   0.0000000000000000   0.0072441627495198   8.0042185153677305
Ba   Ti   O    H 
8  8  22  1  
Direct
  0.0064722332806636  0.0035390495021321  0.9963482384428698  
  0.0052123171445621  0.0018971246710567  0.5041576571726917  
  0.4935277667193364  0.0035390495021321  0.9963482384428698  
  0.0066169055407920  0.4972384143654868  0.9967144262718244  
  0.0050023340809148  0.4983954868892301  0.5039043890666349  
  0.4947876828554382  0.0018971246710567  0.5041576571726917  
  0.4933830944592079  0.4972384143654868  0.9967144262718244  
  0.4949976659190853  0.4983954868892301  0.5039043890666349  
  0.2500000000000000  0.2517082655948686  0.2500950398542542  
  0.7500000000000000  0.7496316669766460  0.7613323890458293  
  0.7500000000000000  0.7655847038922230  0.2354945025411919  
  0.2500000000000000  0.2498978358183439  0.7491466342306812  
  0.7500000000000000  0.2532650821592454  0.7550260713203194  
  0.2500000000000000  0.7483216445221115  0.2511185507440728  
  0.2500000000000000  0.7502494970208001  0.7487442889022664  
  0.7500000000000000  0.2336038336931355  0.2558595504264271  
  0.2500000000000000  0.2497179846317673  0.0004101904818716  
  0.7500000000000000  0.7436394447617438  0.0033054034246876  
  0.7500000000000000  0.2554218635842795  0.0004350809514933  
  0.2500000000000000  0.7502440511507135  0.0009657818474243  
  0.9955982633384300  0.2547495806314719  0.2499133558018095  
  0.9964724363121360  0.7503321339260955  0.7463897130593463  
  0.9910453631052740  0.7425030372312952  0.2536446151726778  
  0.9994227894381464  0.2501273075427703  0.7495904730515419  
  0.2500000000000000  0.9991411880006956  0.2505002967126415  
  0.7500000000000000  0.9966876227823956  0.7479540257649570  
  0.2500000000000000  0.9999564552089584  0.7497853039503178  
  0.7500000000000000  0.9984878995272471  0.2526044497315414  
  0.2500000000000000  0.2498956469660888  0.4998214691749102  
  0.7500000000000000  0.2590419795792855  0.4930808448241469  
  0.2500000000000000  0.7501741855550732  0.4995242138779452  
  0.5044017366615700  0.2547495806314719  0.2499133558018095  
  0.5035275636878641  0.7503321339260955  0.7463897130593463  
  0.5089546368947259  0.7425030372312952  0.2536446151726778  
  0.5005772105618537  0.2501273075427703  0.7495904730515419  
  0.2500000000000000  0.4996122195762272  0.2501297727553368  
  0.7500000000000000  0.5040790234637287  0.7472235790523909  
  0.2500000000000000  0.5004884234971408  0.7503077668856321  
  0.7500000000000000  0.7435852125182072  0.4958090574208344  
