# generated using pymatgen
data_LiZr3N4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.54833067
_cell_length_b   5.54833013
_cell_length_c   5.54833163
_cell_angle_alpha   132.01077722
_cell_angle_beta   132.01076254
_cell_angle_gamma   70.21202493
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiZr3N4
_chemical_formula_sum   'Li1 Zr3 N4'
_cell_volume   92.42532952
_cell_formula_units_Z   1
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
  Li  Li0  1  0.25000000  0.75000000  0.50000000  1.0
  Zr  Zr1  1  0.50000000  0.50000000  0.00000000  1.0
  Zr  Zr2  1  0.00000000  0.00000000  0.00000000  1.0
  Zr  Zr3  1  0.75000000  0.25000000  0.50000000  1.0
  N  N4  1  0.74999628  0.74999628  0.00000000  1.0
  N  N5  1  0.25000372  0.25000372  1.00000000  1.0
  N  N6  1  0.99203522  0.49203522  0.50000000  1.0
  N  N7  1  0.50796478  0.00796478  0.50000000  1.0