# generated using pymatgen
data_MgAl2(CuO2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.15251480
_cell_length_b   6.15251898
_cell_length_c   6.15250738
_cell_angle_alpha   60.05853890
_cell_angle_beta   60.05852739
_cell_angle_gamma   60.05857029
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgAl2(CuO2)4
_chemical_formula_sum   'Mg1 Al2 Cu4 O8'
_cell_volume   164.89923880
_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  0.12554200  0.12554200  0.12554200  1.0
  Al  Al1  1  0.62442700  0.62442600  0.62442700  1.0
  Al  Al2  1  0.37551000  0.37551100  0.37551000  1.0
  Cu  Cu3  1  0.97695100  0.56718600  0.97695100  1.0
  Cu  Cu4  1  0.97763800  0.97763800  0.97763900  1.0
  Cu  Cu5  1  0.56718600  0.97695100  0.97695100  1.0
  Cu  Cu6  1  0.97695100  0.97695100  0.56718600  1.0
  O  O7  1  0.26205200  0.74571700  0.74571800  1.0
  O  O8  1  0.25364900  0.25365000  0.74124600  1.0
  O  O9  1  0.25365000  0.74124600  0.25364900  1.0
  O  O10  1  0.25364600  0.25364600  0.25364500  1.0
  O  O11  1  0.74571800  0.74571700  0.26205200  1.0
  O  O12  1  0.74124600  0.25365000  0.25364900  1.0
  O  O13  1  0.74571700  0.26205200  0.74571800  1.0
  O  O14  1  0.74511600  0.74511600  0.74511700  1.0