# generated using pymatgen
data_Sr2TaN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.39790347
_cell_length_b   6.39790347
_cell_length_c   12.61895072
_cell_angle_alpha   88.92517266
_cell_angle_beta   88.92517266
_cell_angle_gamma   123.84589000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2TaN3
_chemical_formula_sum   'Sr8 Ta4 N12'
_cell_volume   428.66029498
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  'x, y, z'
loop_
 _atom_site_type_symbol
 _atom_site_label
 _atom_site_symmetry_multiplicity
 _atom_site_fract_x
 _atom_site_fract_y
 _atom_site_fract_z
 _atom_site_occupancy
  Sr  Sr0  1  0.94469051  0.54202491  0.14054400  1.0
  Sr  Sr1  1  0.15359886  0.38530087  0.42349448  1.0
  Sr  Sr2  1  0.38530087  0.15359886  0.92349448  1.0
  Sr  Sr3  1  0.84640114  0.61469913  0.57650552  1.0
  Sr  Sr4  1  0.05530949  0.45797509  0.85945600  1.0
  Sr  Sr5  1  0.54202491  0.94469051  0.64054400  1.0
  Sr  Sr6  1  0.45797509  0.05530949  0.35945600  1.0
  Sr  Sr7  1  0.61469913  0.84640114  0.07650552  1.0
  Ta  Ta8  1  0.76753192  0.76380006  0.33626405  1.0
  Ta  Ta9  1  0.23619994  0.23246808  0.16373595  1.0
  Ta  Ta10  1  0.23246808  0.23619994  0.66373595  1.0
  Ta  Ta11  1  0.76380006  0.76753192  0.83626405  1.0
  N  N12  1  0.49839045  0.50160955  0.75000000  1.0
  N  N13  1  0.50160955  0.49839045  0.25000000  1.0
  N  N14  1  0.08300355  0.91699645  0.75000000  1.0
  N  N15  1  0.91699645  0.08300355  0.25000000  1.0
  N  N16  1  0.00705569  0.33254150  0.62532263  1.0
  N  N17  1  0.66745850  0.99294431  0.87467737  1.0
  N  N18  1  0.99294431  0.66745850  0.37467737  1.0
  N  N19  1  0.33254150  0.00705569  0.12532263  1.0
  N  N20  1  0.80422225  0.61746482  0.95876589  1.0
  N  N21  1  0.61746482  0.80422225  0.45876589  1.0
  N  N22  1  0.19577775  0.38253518  0.04123411  1.0
  N  N23  1  0.38253518  0.19577775  0.54123411  1.0