# generated using pymatgen
data_Cu2H3ClO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.08212100
_cell_length_b   6.95305600
_cell_length_c   9.18649900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cu2H3ClO3
_chemical_formula_sum   'Cu8 H12 Cl4 O12'
_cell_volume   388.49086857
_cell_formula_units_Z   4
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  0.00000000  0.00000000  0.00000000  1.0
  Cu  Cu1  1  0.50000000  0.50000000  0.50000000  1.0
  Cu  Cu2  1  0.00000000  0.50000000  0.00000000  1.0
  Cu  Cu3  1  0.50000000  0.00000000  0.50000000  1.0
  Cu  Cu4  1  0.18473100  0.25000000  0.25697800  1.0
  Cu  Cu5  1  0.68473100  0.25000000  0.24302200  1.0
  Cu  Cu6  1  0.81526900  0.75000000  0.74302200  1.0
  Cu  Cu7  1  0.31526900  0.75000000  0.75697800  1.0
  H  H8  1  0.70688400  0.75000000  0.04647000  1.0
  H  H9  1  0.20688400  0.75000000  0.45353000  1.0
  H  H10  1  0.29311600  0.25000000  0.95353000  1.0
  H  H11  1  0.79311600  0.25000000  0.54647000  1.0
  H  H12  1  0.41994700  0.54759600  0.22754700  1.0
  H  H13  1  0.91994700  0.95240400  0.27245300  1.0
  H  H14  1  0.58005300  0.04759600  0.77245300  1.0
  H  H15  1  0.08005300  0.45240400  0.72754700  1.0
  H  H16  1  0.58005300  0.45240400  0.77245300  1.0
  H  H17  1  0.08005300  0.04759600  0.72754700  1.0
  H  H18  1  0.41994700  0.95240400  0.22754700  1.0
  H  H19  1  0.91994700  0.54759600  0.27245300  1.0
  Cl  Cl20  1  0.36951200  0.75000000  0.06848800  1.0
  Cl  Cl21  1  0.86951200  0.75000000  0.43151200  1.0
  Cl  Cl22  1  0.63048800  0.25000000  0.93151200  1.0
  Cl  Cl23  1  0.13048800  0.25000000  0.56848800  1.0
  O  O24  1  0.14544600  0.25000000  0.99933500  1.0
  O  O25  1  0.64544600  0.25000000  0.50066500  1.0
  O  O26  1  0.85455400  0.75000000  0.00066500  1.0
  O  O27  1  0.35455400  0.75000000  0.49933500  1.0
  O  O28  1  0.43349600  0.06582800  0.29366400  1.0
  O  O29  1  0.93349600  0.43417200  0.20633600  1.0
  O  O30  1  0.56650400  0.56582800  0.70633600  1.0
  O  O31  1  0.06650400  0.93417200  0.79366400  1.0
  O  O32  1  0.56650400  0.93417200  0.70633600  1.0
  O  O33  1  0.06650400  0.56582800  0.79366400  1.0
  O  O34  1  0.43349600  0.43417200  0.29366400  1.0
  O  O35  1  0.93349600  0.06582800  0.20633600  1.0