# generated using pymatgen
data_Mg2TaN3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.87376710
_cell_length_b   5.93900580
_cell_length_c   5.27029013
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.36809616
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2TaN3
_chemical_formula_sum   'Mg4 Ta2 N6'
_cell_volume   158.62541496
_cell_formula_units_Z   2
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
  Mg  Mg0  1  0.33923150  0.33250456  0.48626842  1.0
  Mg  Mg1  1  0.66076850  0.99327407  0.48626842  1.0
  Mg  Mg2  1  0.66076850  0.66749544  0.98626842  1.0
  Mg  Mg3  1  0.33923150  0.00672593  0.98626842  1.0
  Ta  Ta4  1  -0.00000000  0.66855745  0.48498190  1.0
  Ta  Ta5  1  0.00000000  0.33144255  0.98498190  1.0
  N  N6  1  0.31188843  0.33092265  0.88463662  1.0
  N  N7  1  0.68811157  0.01903522  0.88463662  1.0
  N  N8  1  0.68811157  0.66907735  0.38463662  1.0
  N  N9  1  0.31188843  0.98096478  0.38463662  1.0
  N  N10  1  -0.00000000  0.64999693  0.86120804  1.0
  N  N11  1  0.00000000  0.35000307  0.36120804  1.0