# generated using pymatgen
data_CaCuSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.12145754
_cell_length_b   4.12133103
_cell_length_c   4.08101200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   60.01503107
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CaCuSi
_chemical_formula_sum   'Ca1 Cu1 Si1'
_cell_volume   60.04164631
_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  0.99975900  0.00003300  0.00000000  1.0
  Cu  Cu1  1  0.66696800  0.66618300  0.50000000  1.0
  Si  Si2  1  0.33317300  0.33378400  0.50000000  1.0