# generated using pymatgen
data_TbNiO3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.17983298
_cell_length_b   5.49717878
_cell_length_c   7.41193760
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TbNiO3
_chemical_formula_sum   'Tb4 Ni4 O12'
_cell_volume   211.05097958
_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
  Tb  Tb0  1  0.01829304  0.92895588  0.25000000  1.0
  Tb  Tb1  1  0.48170696  0.42895588  0.25000000  1.0
  Tb  Tb2  1  0.51829304  0.57104412  0.75000000  1.0
  Tb  Tb3  1  0.98170696  0.07104412  0.75000000  1.0
  Ni  Ni4  1  -0.00000000  0.50000000  -0.00000000  1.0
  Ni  Ni5  1  -0.00000000  0.50000000  0.50000000  1.0
  Ni  Ni6  1  0.50000000  -0.00000000  -0.00000000  1.0
  Ni  Ni7  1  0.50000000  -0.00000000  0.50000000  1.0
  O  O8  1  0.09511571  0.47576838  0.75000000  1.0
  O  O9  1  0.19768351  0.19803909  0.45180915  1.0
  O  O10  1  0.19768351  0.19803909  0.04819085  1.0
  O  O11  1  0.30231649  0.69803909  0.45180915  1.0
  O  O12  1  0.30231649  0.69803909  0.04819085  1.0
  O  O13  1  0.40488429  0.97576838  0.75000000  1.0
  O  O14  1  0.59511571  0.02423162  0.25000000  1.0
  O  O15  1  0.69768351  0.30196091  0.95180915  1.0
  O  O16  1  0.69768351  0.30196091  0.54819085  1.0
  O  O17  1  0.80231649  0.80196091  0.95180915  1.0
  O  O18  1  0.80231649  0.80196091  0.54819085  1.0
  O  O19  1  0.90488429  0.52423162  0.25000000  1.0