# generated using pymatgen
data_Sc(CuO2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.10707969
_cell_length_b   6.01562670
_cell_length_c   6.10706900
_cell_angle_alpha   126.20808802
_cell_angle_beta   79.87436483
_cell_angle_gamma   127.08012686
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc(CuO2)2
_chemical_formula_sum   'Sc2 Cu4 O8'
_cell_volume   138.64131445
_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  0.87611569  0.74999954  0.62611660  1.0
  Sc  Sc1  1  0.12388431  0.25000046  0.37388340  1.0
  Cu  Cu2  1  0.50000000  0.00000000  -0.00000000  1.0
  Cu  Cu3  1  0.50000000  0.50000000  -0.00000000  1.0
  Cu  Cu4  1  0.50000000  0.00000000  0.50000000  1.0
  Cu  Cu5  1  0.00000000  0.50000000  -0.00000000  1.0
  O  O6  1  0.82436840  0.70117128  0.22986992  1.0
  O  O7  1  0.47130801  0.20117678  0.37680469  1.0
  O  O8  1  0.73552556  0.89550682  0.01990135  1.0
  O  O9  1  0.87559814  0.39549346  0.65997514  1.0
  O  O10  1  0.12440186  0.60450654  0.34002486  1.0
  O  O11  1  0.26447444  0.10449318  0.98009865  1.0
  O  O12  1  0.52869199  0.79882322  0.62319531  1.0
  O  O13  1  0.17563160  0.29882872  0.77013008  1.0