# generated using pymatgen
data_MgTa2N3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.21319805
_cell_length_b   5.21319792
_cell_length_c   10.45844829
_cell_angle_alpha   89.99999718
_cell_angle_beta   90.00000441
_cell_angle_gamma   119.99966921
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgTa2N3
_chemical_formula_sum   'Mg4 Ta8 N12'
_cell_volume   246.15449462
_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
  Mg  Mg0  1  0.33333354  0.66666646  0.00000104  1.0
  Mg  Mg1  1  0.33333353  0.66666648  0.49999886  1.0
  Mg  Mg2  1  0.66666636  0.33333347  0.49999888  1.0
  Mg  Mg3  1  0.66666641  0.33333357  0.00000109  1.0
  Ta  Ta4  1  0.00000018  0.33605858  0.25002097  1.0
  Ta  Ta5  1  0.66394134  -0.00000011  0.74997924  1.0
  Ta  Ta6  1  0.33605843  0.33605845  0.74997924  1.0
  Ta  Ta7  1  0.00000004  0.00000003  0.49999997  1.0
  Ta  Ta8  1  0.00000001  0.00000002  0.00000072  1.0
  Ta  Ta9  1  0.66394166  0.66394162  0.25002098  1.0
  Ta  Ta10  1  0.33605860  0.00000012  0.25002095  1.0
  Ta  Ta11  1  -0.00000011  0.66394132  0.74997927  1.0
  N  N12  1  0.67101829  0.67101830  0.61957658  1.0
  N  N13  1  0.67102103  0.67102106  0.88040730  1.0
  N  N14  1  0.32897992  0.32897994  0.11959369  1.0
  N  N15  1  0.32898221  0.32898219  0.38042268  1.0
  N  N16  1  0.32897931  -0.00000010  0.88040736  1.0
  N  N17  1  0.32898200  -0.00000017  0.61957656  1.0
  N  N18  1  0.00000016  0.67101746  0.38042275  1.0
  N  N19  1  0.00000012  0.67101972  0.11959362  1.0
  N  N20  1  0.67101972  0.00000013  0.11959362  1.0
  N  N21  1  0.67101750  0.00000010  0.38042275  1.0
  N  N22  1  -0.00000011  0.32897935  0.88040735  1.0
  N  N23  1  -0.00000014  0.32898200  0.61957654  1.0