# generated using pymatgen
data_LiCaBi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.71369701
_cell_length_b   7.81529878
_cell_length_c   8.56189142
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiCaBi
_chemical_formula_sum   'Li4 Ca4 Bi4'
_cell_volume   315.41109414
_cell_formula_units_Z   4
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  0.75000000  0.35193193  0.93047266  1
  Li  Li1  1  0.75000000  0.85193193  0.56952734  1
  Li  Li2  1  0.25000000  0.14806807  0.43047266  1
  Li  Li3  1  0.25000000  0.64806807  0.06952734  1
  Ca  Ca4  1  0.25000000  0.01374795  0.80092682  1
  Ca  Ca5  1  0.75000000  0.48625205  0.30092682  1
  Ca  Ca6  1  0.75000000  0.98625205  0.19907318  1
  Ca  Ca7  1  0.25000000  0.51374795  0.69907318  1
  Bi  Bi8  1  0.75000000  0.73271224  0.89633316  1
  Bi  Bi9  1  0.25000000  0.26728776  0.10366684  1
  Bi  Bi10  1  0.25000000  0.76728776  0.39633316  1
  Bi  Bi11  1  0.75000000  0.23271224  0.60366684  1
