# generated using pymatgen
data_Mg2Ta3N5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.19966388
_cell_length_b   8.19966388
_cell_length_c   5.31892059
_cell_angle_alpha   83.84846574
_cell_angle_beta   83.84846574
_cell_angle_gamma   141.85117872
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg2Ta3N5
_chemical_formula_sum   'Mg4 Ta6 N10'
_cell_volume   208.68738934
_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  0.44891200  0.55108800  0.75000000  1.0
  Mg  Mg1  1  0.55108800  0.44891200  0.25000000  1.0
  Mg  Mg2  1  0.25151400  0.74848600  0.75000000  1.0
  Mg  Mg3  1  0.74848600  0.25151400  0.25000000  1.0
  Ta  Ta4  1  0.85066800  0.14933200  0.75000000  1.0
  Ta  Ta5  1  0.35265300  0.64734700  0.25000000  1.0
  Ta  Ta6  1  0.04625900  0.95374100  0.75000000  1.0
  Ta  Ta7  1  0.95374100  0.04625900  0.25000000  1.0
  Ta  Ta8  1  0.64734700  0.35265300  0.75000000  1.0
  Ta  Ta9  1  0.14933200  0.85066800  0.25000000  1.0
  N  N10  1  0.09494400  0.39537700  0.00031900  1.0
  N  N11  1  0.69028800  0.78880900  0.99819900  1.0
  N  N12  1  0.60462300  0.90505600  0.49968100  1.0
  N  N13  1  0.30971200  0.21119100  0.00180100  1.0
  N  N14  1  0.21119100  0.30971200  0.50180100  1.0
  N  N15  1  0.90505600  0.60462300  0.99968100  1.0
  N  N16  1  0.78880900  0.69028800  0.49819900  1.0
  N  N17  1  0.50000000  0.00000000  0.00000000  1.0
  N  N18  1  0.39537700  0.09494400  0.50031900  1.0
  N  N19  1  0.00000000  0.50000000  0.50000000  1.0