# generated using pymatgen
data_CuNi4O5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.29602165
_cell_length_b   12.29602165
_cell_length_c   5.15971656
_cell_angle_alpha   85.90129671
_cell_angle_beta   85.90129671
_cell_angle_gamma   13.92539410
_symmetry_Int_Tables_number   1
_chemical_formula_structural   CuNi4O5
_chemical_formula_sum   'Cu2 Ni8 O10'
_cell_volume   187.25224553
_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
  Cu  Cu0  1  0.90001300  0.90001300  0.69953100  1.0
  Cu  Cu1  1  0.09998700  0.09998700  0.30046900  1.0
  Ni  Ni2  1  0.20035300  0.20035300  0.60026400  1.0
  Ni  Ni3  1  0.69949500  0.69949500  0.10008300  1.0
  Ni  Ni4  1  0.60003000  0.60003000  0.79966000  1.0
  Ni  Ni5  1  0.50000000  0.50000000  0.50000000  1.0
  Ni  Ni6  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni7  1  0.30050500  0.30050500  0.89991700  1.0
  Ni  Ni8  1  0.39997000  0.39997000  0.20034000  1.0
  Ni  Ni9  1  0.79964700  0.79964700  0.39973600  1.0
  O  O10  1  0.75033800  0.75033800  0.75107000  1.0
  O  O11  1  0.65106000  0.65106000  0.45426300  1.0
  O  O12  1  0.15035600  0.15035600  0.94595300  1.0
  O  O13  1  0.04944000  0.04944000  0.65331800  1.0
  O  O14  1  0.24966200  0.24966200  0.24893000  1.0
  O  O15  1  0.34894000  0.34894000  0.54573700  1.0
  O  O16  1  0.45109900  0.45109900  0.85340600  1.0
  O  O17  1  0.54890100  0.54890100  0.14659400  1.0
  O  O18  1  0.84964400  0.84964400  0.05404700  1.0
  O  O19  1  0.95056000  0.95056000  0.34668200  1.0