# generated using pymatgen
data_Re2NiO6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.76281300
_cell_length_b   4.76281300
_cell_length_c   8.48714700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Re2NiO6
_chemical_formula_sum   'Re4 Ni2 O12'
_cell_volume   192.52573279
_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
  Re  Re0  1  0.50000000  0.50000000  0.34704400  1.0
  Re  Re1  1  0.50000000  0.50000000  0.65295600  1.0
  Re  Re2  1  0.00000000  0.00000000  0.84704400  1.0
  Re  Re3  1  0.00000000  0.00000000  0.15295600  1.0
  Ni  Ni4  1  0.50000000  0.50000000  0.00000000  1.0
  Ni  Ni5  1  0.00000000  0.00000000  0.50000000  1.0
  O  O6  1  0.21887700  0.78112300  0.00000000  1.0
  O  O7  1  0.21076800  0.78923200  0.32410500  1.0
  O  O8  1  0.21076800  0.78923200  0.67589500  1.0
  O  O9  1  0.78112300  0.21887700  0.00000000  1.0
  O  O10  1  0.78923200  0.21076800  0.32410500  1.0
  O  O11  1  0.78923200  0.21076800  0.67589500  1.0
  O  O12  1  0.28923200  0.28923200  0.17589500  1.0
  O  O13  1  0.28112300  0.28112300  0.50000000  1.0
  O  O14  1  0.28923200  0.28923200  0.82410500  1.0
  O  O15  1  0.71076800  0.71076800  0.17589500  1.0
  O  O16  1  0.71887700  0.71887700  0.50000000  1.0
  O  O17  1  0.71076800  0.71076800  0.82410500  1.0