# generated using pymatgen
data_Nd(CuO2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.74473756
_cell_length_b   5.82626798
_cell_length_c   6.31501035
_cell_angle_alpha   116.93578785
_cell_angle_beta   116.48618103
_cell_angle_gamma   91.09403500
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Nd(CuO2)2
_chemical_formula_sum   'Nd2 Cu4 O8'
_cell_volume   162.05284924
_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
  Nd  Nd0  1  0.87456657  0.12455242  0.74913667  1.0
  Nd  Nd1  1  0.12543343  0.87544758  0.25086333  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  -0.00000000  0.50000000  0.50000000  1.0
  Cu  Cu5  1  0.50000000  0.50000000  0.50000000  1.0
  O  O6  1  0.70826832  0.52838500  0.85396423  1.0
  O  O7  1  0.14568331  0.82562332  0.85399436  1.0
  O  O8  1  0.29173168  0.47161500  0.14603577  1.0
  O  O9  1  0.85431669  0.17437668  0.14600564  1.0
  O  O10  1  0.53729664  0.14310123  0.34753559  1.0
  O  O11  1  0.81025850  0.70440532  0.34753886  1.0
  O  O12  1  0.18974150  0.29559468  0.65246114  1.0
  O  O13  1  0.46270336  0.85689877  0.65246441  1.0