16
Lattice="9.147704547916517 -4.9217803271497445e-17 -5.2674173546019584e-17 4.396411451566896e-16 5.6327037520347 4.86612122664997e-07 4.187715775256406e-16 5.078111804407254e-07 7.400917412909152" Properties=species:S:1:pos:R:3:forces:R:3 energy=710.3644929117245 stress="-3.8401807892909425e-05 0.0 0.0 0.0 -0.000891007602976326 -1.780347839252227e-09 0.0 -1.780347839252227e-09 0.0006244911020359533" pbc="T T T"
Zr       4.57385227       2.02912834       3.52156670       0.00000000      -0.00557558       0.00571478
Zr       0.00000000       3.60357740      -0.17889103       0.00000000       0.00557445       0.00571404
Ba       4.57385227       4.34341455       6.81804200       0.00000000      -0.00572700      -0.00692289
Ba       0.00000000       1.28929170       3.11758291       0.00000000       0.00572621      -0.00692191
Cu       6.89970855       3.68174618       3.85738043       0.00126887       0.00507937      -0.00449699
Cu       2.24799600       3.68174618       3.85738043      -0.00126887       0.00507937      -0.00449699
Cu       6.82184813       1.95095986       7.55783771      -0.00126902      -0.00508075      -0.00449762
Cu       2.32585642       1.95095986       7.55783771       0.00126902      -0.00508075      -0.00449762
Se       4.57385227       1.42131482       0.98902079       0.00000000       0.00039657      -0.00216483
Se       0.00000000       4.21139047       4.68948031       0.00000000      -0.00039577      -0.00216585
Se       4.57385227       4.63942604       3.59808284       0.00000000       0.00821638       0.00405435
Se       0.00000000       0.99327927      -0.10237578       0.00000000      -0.00821714       0.00405350
Se       7.21648401       3.97400350       1.43189638       0.00320726      -0.00482830       0.00349500
Se       1.93122054       3.97400350       1.43189638      -0.00320726      -0.00482830       0.00349500
Se       6.50507277       1.65870021       5.13235383      -0.00320750       0.00483062       0.00349728
Se       2.64263177       1.65870021       5.13235383       0.00320750       0.00483062       0.00349728