 Ba H Cl O
   1.0
     4.4816529400000000    0.0000000000000000    0.0000000000000000
     0.0000000000000000    4.4816529400000000    0.0000000000000000
     0.0000000000000000    0.0000000000000000   11.5596615000000007
 Ba H Cl O
   2  10   2   6
Direct
   0.0000000000000000  0.5000000000000000  0.8220877700000000
   0.5000000000000000  0.0000000000000000  0.1779122300000000
   0.1852963600000000  0.0000000000000000  0.6308180600000000
   0.8147036400000001  0.0000000000000000  0.6308180600000000
   0.5000000000000000  0.6852963599999999  0.6308180600000000
   0.5000000000000000  0.3147036400000000  0.6308180600000000
   0.3147036400000000  0.5000000000000000  0.3691819400000000
   0.6852963599999999  0.5000000000000000  0.3691819400000000
   0.0000000000000000  0.8147036400000001  0.3691819400000000
   0.0000000000000000  0.1852963600000000  0.3691819400000000
   0.5000000000000000  0.0000000000000000  0.4887888800000000
   0.0000000000000000  0.5000000000000000  0.5112111200000000
   0.5000000000000000  0.0000000000000000  0.9056062700000000
   0.0000000000000000  0.5000000000000000  0.0943937300000000
   0.0000000000000000  0.0000000000000000  0.6828934500000000
   0.5000000000000000  0.5000000000000000  0.6828934500000000
   0.5000000000000000  0.5000000000000000  0.3171065500000000
   0.0000000000000000  0.0000000000000000  0.3171065500000000
   0.5000000000000000  0.0000000000000000  0.5730970900000000
   0.0000000000000000  0.5000000000000000  0.4269029100000000