# generated using pymatgen
data_Mg3Cu
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.57845657
_cell_length_b   5.57845657
_cell_length_c   5.57845657
_cell_angle_alpha   146.19988712
_cell_angle_beta   129.35857196
_cell_angle_gamma   62.27974672
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg3Cu
_chemical_formula_sum   'Mg3 Cu1'
_cell_volume   73.89284103
_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
  Mg  Mg0  1  0.79250832  0.71800336  0.07450395  1.0
  Mg  Mg1  1  0.08660540  0.50000000  0.58660540  1.0
  Mg  Mg2  1  0.35650059  0.28199664  0.07450395  1.0
  Cu  Cu3  1  0.59771270  -0.00000000  0.59771270  1.0