# generated using pymatgen
data_Ba10Ti8NbNiO30
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   21.13695170
_cell_length_b   21.13695170
_cell_length_c   21.13695170
_cell_angle_alpha   164.49651255
_cell_angle_beta   164.49651255
_cell_angle_gamma   21.99319031
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Ba10Ti8NbNiO30
_chemical_formula_sum   'Ba10 Ti8 Nb1 Ni1 O30'
_cell_volume   674.59133228
_cell_formula_units_Z   1
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
  Ba  Ba0  1  0.65032700  0.15032700  0.50000000  1.0
  Ba  Ba1  1  0.05018100  0.55018100  0.50000000  1.0
  Ba  Ba2  1  0.44981900  0.94981900  0.50000000  1.0
  Ba  Ba3  1  0.84967300  0.34967300  0.50000000  1.0
  Ba  Ba4  1  0.25000000  0.75000000  0.50000000  1.0
  Ba  Ba5  1  0.55018100  0.05018100  0.50000000  1.0
  Ba  Ba6  1  0.94981900  0.44981900  0.50000000  1.0
  Ba  Ba7  1  0.34967300  0.84967300  0.50000000  1.0
  Ba  Ba8  1  0.75000000  0.25000000  0.50000000  1.0
  Ba  Ba9  1  0.15032700  0.65032700  0.50000000  1.0
  Ti  Ti10  1  0.90260400  0.90260400  0.00000000  1.0
  Ti  Ti11  1  0.29690400  0.29690400  0.00000000  1.0
  Ti  Ti12  1  0.70309600  0.70309600  0.00000000  1.0
  Ti  Ti13  1  0.09739600  0.09739600  0.00000000  1.0
  Ti  Ti14  1  0.39697100  0.39697100  0.00000000  1.0
  Ti  Ti15  1  0.80288800  0.80288800  0.00000000  1.0
  Ti  Ti16  1  0.19711200  0.19711200  0.00000000  1.0
  Ti  Ti17  1  0.60302900  0.60302900  0.00000000  1.0
  Nb  Nb18  1  0.50000000  0.50000000  0.00000000  1.0
  Ni  Ni19  1  0.00000000  0.00000000  0.00000000  1.0
  O  O20  1  0.15289800  0.15289800  0.00000000  1.0
  O  O21  1  0.55009100  0.55009100  0.00000000  1.0
  O  O22  1  0.94632800  0.94632800  0.00000000  1.0
  O  O23  1  0.35164100  0.35164100  0.00000000  1.0
  O  O24  1  0.74766400  0.74766400  0.00000000  1.0
  O  O25  1  0.85154600  0.35054600  0.00000000  1.0
  O  O26  1  0.25104200  0.74895800  0.00000000  1.0
  O  O27  1  0.64945400  0.14845400  0.00000000  1.0
  O  O28  1  0.04947600  0.54982100  0.00000000  1.0
  O  O29  1  0.45017900  0.95052400  0.00000000  1.0
  O  O30  1  0.85154600  0.85154600  0.50099900  1.0
  O  O31  1  0.25104200  0.25104200  0.50208400  1.0
  O  O32  1  0.64945400  0.64945400  0.50099900  1.0
  O  O33  1  0.04947600  0.04947600  0.49965500  1.0
  O  O34  1  0.45017900  0.45017900  0.49965500  1.0
  O  O35  1  0.05367200  0.05367200  0.00000000  1.0
  O  O36  1  0.44990900  0.44990900  0.00000000  1.0
  O  O37  1  0.84710200  0.84710200  0.00000000  1.0
  O  O38  1  0.25233600  0.25233600  0.00000000  1.0
  O  O39  1  0.64835900  0.64835900  0.00000000  1.0
  O  O40  1  0.35054600  0.85154600  0.00000000  1.0
  O  O41  1  0.74895800  0.25104200  0.00000000  1.0
  O  O42  1  0.14845400  0.64945400  0.00000000  1.0
  O  O43  1  0.54982100  0.04947600  0.00000000  1.0
  O  O44  1  0.95052400  0.45017900  0.00000000  1.0
  O  O45  1  0.35054600  0.35054600  0.49900100  1.0
  O  O46  1  0.74895800  0.74895800  0.49791600  1.0
  O  O47  1  0.14845400  0.14845400  0.49900100  1.0
  O  O48  1  0.54982100  0.54982100  0.50034500  1.0
  O  O49  1  0.95052400  0.95052400  0.50034500  1.0