# generated using pymatgen
data_Cu5Se2(ClO4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.59734897
_cell_length_b   6.03631141
_cell_length_c   13.71256389
_cell_angle_alpha   89.99999447
_cell_angle_beta   90.00002561
_cell_angle_gamma   95.29871366
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu5Se2(ClO4)2
_chemical_formula_sum   'Cu10 Se4 Cl4 O16'
_cell_volume   461.33124428
_cell_formula_units_Z   2
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
  Cu  Cu0  1  0.51112363  0.74172146  0.00309174  1.0
  Cu  Cu1  1  0.05534535  0.43439756  0.31078781  1.0
  Cu  Cu2  1  0.94465465  0.56560144  0.68921219  1.0
  Cu  Cu3  1  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu4  1  0.55534535  0.43439756  0.18921319  1.0
  Cu  Cu5  1  0.44465465  0.56560144  0.81078681  1.0
  Cu  Cu6  1  0.01112363  0.74172046  0.49690826  1.0
  Cu  Cu7  1  0.48887637  0.25827854  0.99690826  1.0
  Cu  Cu8  1  -0.00000000  0.50000000  0.00000000  1.0
  Cu  Cu9  1  0.98887637  0.25827954  0.50309174  1.0
  Se  Se10  1  0.59870704  0.93814484  0.63534188  1.0
  Se  Se11  1  0.90129296  0.06185516  0.13534288  1.0
  Se  Se12  1  0.09870704  0.93814484  0.86465712  1.0
  Se  Se13  1  0.40129296  0.06185516  0.36465812  1.0
  Cl  Cl14  1  0.23245486  0.32796279  0.67508249  1.0
  Cl  Cl15  1  0.73245486  0.32796279  0.82491551  1.0
  Cl  Cl16  1  0.76754514  0.67203721  0.32491751  1.0
  Cl  Cl17  1  0.26754514  0.67203721  0.17508449  1.0
  O  O18  1  0.42511801  0.77603692  0.55709075  1.0
  O  O19  1  0.18106888  0.50493306  0.43943941  1.0
  O  O20  1  0.63073918  0.02609542  0.07382511  1.0
  O  O21  1  0.68106888  0.50493306  0.06056159  1.0
  O  O22  1  0.31798639  0.25186330  0.27787368  1.0
  O  O23  1  0.07488199  0.22396308  0.05709075  1.0
  O  O24  1  0.57488199  0.22396308  0.44290925  1.0
  O  O25  1  0.81893112  0.49506694  0.56056059  1.0
  O  O26  1  0.86926082  0.97390458  0.57382411  1.0
  O  O27  1  0.18201261  0.74813670  0.77787268  1.0
  O  O28  1  0.68201361  0.74813670  0.72212632  1.0
  O  O29  1  0.31893112  0.49506694  0.93943841  1.0
  O  O30  1  0.81798739  0.25186330  0.22212732  1.0
  O  O31  1  0.92511801  0.77603692  0.94290925  1.0
  O  O32  1  0.13073918  0.02609542  0.42617589  1.0
  O  O33  1  0.36926082  0.97390458  0.92617489  1.0