# generated using pymatgen
data_CaLa3Si8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.26484300
_cell_length_b   4.26484300
_cell_length_c   14.16153500
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaLa3Si8
_chemical_formula_sum   'Ca1 La3 Si8'
_cell_volume   257.58254308
_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
  Ca  Ca0  1  0.50000000  0.50000000  0.00000000  1.0
  La  La1  1  0.00000000  0.00000000  0.50000000  1.0
  La  La2  1  0.50000000  0.00000000  0.75075300  1.0
  La  La3  1  0.00000000  0.50000000  0.24924700  1.0
  Si  Si4  1  0.00000000  0.00000000  0.91652400  1.0
  Si  Si5  1  0.50000000  0.50000000  0.41547400  1.0
  Si  Si6  1  0.00000000  0.50000000  0.83526200  1.0
  Si  Si7  1  0.50000000  0.00000000  0.33377400  1.0
  Si  Si8  1  0.00000000  0.00000000  0.08347600  1.0
  Si  Si9  1  0.50000000  0.50000000  0.58452600  1.0
  Si  Si10  1  0.50000000  0.00000000  0.16473800  1.0
  Si  Si11  1  0.00000000  0.50000000  0.66622600  1.0