# generated using pymatgen
data_MgCu4(ClO3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.34135919
_cell_length_b   6.34163215
_cell_length_c   5.69771271
_cell_angle_alpha   63.10830854
_cell_angle_beta   63.12194762
_cell_angle_gamma   58.26177901
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCu4(ClO3)2
_chemical_formula_sum   'Mg1 Cu4 Cl2 O6'
_cell_volume   166.72301161
_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  0.99013306  0.00985599  0.50040548  1.0
  Cu  Cu1  1  0.48976891  0.50998783  0.50014636  1.0
  Cu  Cu2  1  0.48992806  0.01022712  0.49973845  1.0
  Cu  Cu3  1  0.98982873  0.51014296  0.49980055  1.0
  Cu  Cu4  1  0.48962084  0.51036903  0.00005097  1.0
  Cl  Cl5  1  0.74267247  0.76617021  0.88559227  1.0
  Cl  Cl6  1  0.23368134  0.25713928  0.11460137  1.0
  O  O7  1  0.74945115  0.34987443  0.67086879  1.0
  O  O8  1  0.32954463  0.76996469  0.67031674  1.0
  O  O9  1  0.78524113  0.80561658  0.30728025  1.0
  O  O10  1  0.22991938  0.67044654  0.32965378  1.0
  O  O11  1  0.65002617  0.25060269  0.32917144  1.0
  O  O12  1  0.19476613  0.21501863  0.69237254  1.0