# generated using pymatgen
data_Li2ZrN2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.27830705
_cell_length_b   3.27830589
_cell_length_c   5.43381109
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000150
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Li2ZrN2
_chemical_formula_sum   'Li2 Zr1 N2'
_cell_volume   50.57481033
_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  0.66666700  0.33333300  0.38357328  1
  Li  Li1  1  0.33333300  0.66666700  0.61642672  1
  Zr  Zr2  1  -0.00000000  -0.00000000  -0.00000000  1
  N  N3  1  0.66666700  0.33333300  0.77689523  1
  N  N4  1  0.33333300  0.66666700  0.22310477  1
