# generated using pymatgen
data_LiNdS2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.93491691
_cell_length_b   6.93491691
_cell_length_c   6.93491691
_cell_angle_alpha   132.05137859
_cell_angle_beta   132.05137859
_cell_angle_gamma   70.14789209
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiNdS2
_chemical_formula_sum   'Li2 Nd2 S4'
_cell_volume   180.26302663
_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
  Li  Li0  1  0.50000000  0.50000000  0.00000000  1.0
  Li  Li1  1  0.25000000  0.75000000  0.50000000  1.0
  Nd  Nd2  1  0.00000000  0.00000000  0.00000000  1.0
  Nd  Nd3  1  0.75000000  0.25000000  0.50000000  1.0
  S  S4  1  0.75056400  0.75056400  0.00000000  1.0
  S  S5  1  0.24943600  0.24943600  0.00000000  1.0
  S  S6  1  0.99943600  0.49943600  0.50000000  1.0
  S  S7  1  0.50056400  0.00056400  0.50000000  1.0