# generated using pymatgen
data_Sr2MgCu(ClO)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.93268383
_cell_length_b   3.93268316
_cell_length_c   12.32426930
_cell_angle_alpha   99.18080292
_cell_angle_beta   99.18080277
_cell_angle_gamma   90.00000379
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sr2MgCu(ClO)2
_chemical_formula_sum   'Sr2 Mg1 Cu1 Cl2 O2'
_cell_volume   185.69159836
_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
  Sr  Sr0  1  0.56962978  0.56962978  0.13925955  1.0
  Sr  Sr1  1  0.43037022  0.43037022  0.86074045  1.0
  Mg  Mg2  1  0.75000000  0.25000000  0.50000000  1.0
  Cu  Cu3  1  0.00000000  0.00000000  0.00000000  1.0
  Cl  Cl4  1  0.12898243  0.12898243  0.25796486  1.0
  Cl  Cl5  1  0.87101757  0.87101757  0.74203514  1.0
  O  O6  1  0.50008055  0.00008055  0.00016110  1.0
  O  O7  1  0.99991945  0.49991945  0.99983890  1.0