 Se Sn Ba
   1.0
    12.3476392700000002    0.0000000000000000    0.0000000000000000
     0.0000000000000000   17.1206326000000004    0.0000000000000000
     0.0000000000000000    0.0000000000000000   17.9987003500000000
 Se Sn Ba
  80  16  32
Direct
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