 H O I Ba
   1.0
    11.0465022800000003    0.0000000000000000   -0.1018445000000000
     0.0000000000000000    7.4141300000000001    0.0000000000000000
    -3.2060656999999999    0.0000000000000000    7.8925073499999998
 H O I Ba
  16   8   8   4
Direct
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