# generated using pymatgen
data_LiNd3S4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.03010407
_cell_length_b   5.69196775
_cell_length_c   8.02869032
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNd3S4
_chemical_formula_sum   'Li1 Nd3 S4'
_cell_volume   184.17191275
_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  0.00000000  0.00000000  0.00000000  1.0
  Nd  Nd1  1  0.50000000  0.50000000  0.24884073  1.0
  Nd  Nd2  1  0.00000000  0.00000000  0.50000000  1.0
  Nd  Nd3  1  0.50000000  0.50000000  0.75115927  1.0
  S  S4  1  0.00000000  0.50000000  0.50000000  1.0
  S  S5  1  0.50000000  0.00000000  0.75929980  1.0
  S  S6  1  0.00000000  0.50000000  0.00000000  1.0
  S  S7  1  0.50000000  0.00000000  0.24070020  1.0