# generated using pymatgen
data_Sc(CuO2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.78934376
_cell_length_b   6.78934376
_cell_length_c   6.78934376
_cell_angle_alpha   130.96239962
_cell_angle_beta   130.96239962
_cell_angle_gamma   71.87282497
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc(CuO2)2
_chemical_formula_sum   'Sc2 Cu4 O8'
_cell_volume   174.55401413
_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
  Sc  Sc0  1  0.00000000  0.00000000  0.00000000  1.0
  Sc  Sc1  1  0.75000000  0.25000000  0.50000000  1.0
  Cu  Cu2  1  0.87500000  0.62500000  0.25000000  1.0
  Cu  Cu3  1  0.37500000  0.62500000  0.75000000  1.0
  Cu  Cu4  1  0.37500000  0.12500000  0.75000000  1.0
  Cu  Cu5  1  0.37500000  0.62500000  0.25000000  1.0
  O  O6  1  0.11887700  0.39215700  0.27328000  1.0
  O  O7  1  0.63112300  0.40440400  0.77328000  1.0
  O  O8  1  0.15440400  0.88112300  0.27328000  1.0
  O  O9  1  0.60784300  0.88112300  0.72672000  1.0
  O  O10  1  0.11887700  0.84559600  0.72672000  1.0
  O  O11  1  0.63112300  0.85784300  0.22672000  1.0
  O  O12  1  0.59559600  0.36887700  0.22672000  1.0
  O  O13  1  0.14215700  0.36887700  0.77328000  1.0