File: POSCAR-unitcell

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phonopy 2.44.0-1
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file content (14 lines) | stat: -rw-r--r-- 608 bytes parent folder | download | duplicates (3)
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Sn O
   1.0
     4.7725812500000000    0.0000000000000000    0.0000000000000000
     0.0000000000000000    4.7725812500000000    0.0000000000000000
     0.0000000000000000    0.0000000000000000    3.2163793900000002
 Sn O
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Direct
   0.0000000000000000  0.0000000000000000  0.0000000000000000
   0.5000000000000000  0.5000000000000000  0.5000000000000000
   0.1937307000000000  0.8062693000000000  0.5000000000000000
   0.8062693000000000  0.1937307000000000  0.5000000000000000
   0.3062693000000000  0.3062693000000000  0.0000000000000000
   0.6937306999999999  0.6937306999999999  0.0000000000000000