# generated using pymatgen
data_BaTb2NiO5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.80384354
_cell_length_b   5.82906063
_cell_length_c   6.71282412
_cell_angle_alpha   115.73271829
_cell_angle_beta   106.45884220
_cell_angle_gamma   90.00000313
_symmetry_Int_Tables_number   1
_chemical_formula_structural   BaTb2NiO5
_chemical_formula_sum   'Ba1 Tb2 Ni1 O5'
_cell_volume   127.27711877
_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  0.00000000  0.00000000  0.00000000  1.0
  Tb  Tb1  1  0.20315200  0.70315200  0.40630400  1.0
  Tb  Tb2  1  0.79684700  0.29684800  0.59369600  1.0
  Ni  Ni3  1  0.50000100  0.50000100  0.00000100  1.0
  O  O4  1  0.00000000  0.50000100  0.00000000  1.0
  O  O5  1  0.35070500  0.59098400  0.70141100  1.0
  O  O6  1  0.64929400  0.40901600  0.29858900  1.0
  O  O7  1  0.64929600  0.88957300  0.29858900  1.0
  O  O8  1  0.35070600  0.11042700  0.70141200  1.0