# generated using pymatgen
data_YCuO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.26202800
_cell_length_b   5.66639000
_cell_length_c   7.49422900
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YCuO3
_chemical_formula_sum   'Y4 Cu4 O12'
_cell_volume   223.45319910
_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
  Y  Y0  1  0.52034000  0.42441700  0.25000000  1.0
  Y  Y1  1  0.02034000  0.07558300  0.75000000  1.0
  Y  Y2  1  0.97966000  0.92441700  0.25000000  1.0
  Y  Y3  1  0.47966000  0.57558300  0.75000000  1.0
  Cu  Cu4  1  0.50000000  0.00000000  0.00000000  1.0
  Cu  Cu5  1  0.00000000  0.50000000  0.00000000  1.0
  Cu  Cu6  1  0.00000000  0.50000000  0.50000000  1.0
  Cu  Cu7  1  0.50000000  0.00000000  0.50000000  1.0
  O  O8  1  0.19908500  0.80538000  0.94852200  1.0
  O  O9  1  0.69908500  0.69462000  0.05147800  1.0
  O  O10  1  0.30091500  0.30538000  0.55147800  1.0
  O  O11  1  0.80091500  0.19462000  0.44852200  1.0
  O  O12  1  0.80091500  0.19462000  0.05147800  1.0
  O  O13  1  0.30091500  0.30538000  0.94852200  1.0
  O  O14  1  0.69908500  0.69462000  0.44852200  1.0
  O  O15  1  0.19908500  0.80538000  0.55147800  1.0
  O  O16  1  0.60331400  0.96890100  0.75000000  1.0
  O  O17  1  0.10331400  0.53109900  0.25000000  1.0
  O  O18  1  0.89668600  0.46890100  0.75000000  1.0
  O  O19  1  0.39668600  0.03109900  0.25000000  1.0