# generated using pymatgen
data_Mn2NiO4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.02148477
_cell_length_b   6.02148482
_cell_length_c   6.02148500
_cell_angle_alpha   60.00000451
_cell_angle_beta   60.00000422
_cell_angle_gamma   60.00000311
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn2NiO4
_chemical_formula_sum   'Mn4 Ni2 O8'
_cell_volume   154.38170678
_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
  Mn  Mn0  1  0.50000000  0.00000000  0.49999900  1.0
  Mn  Mn1  1  0.99999900  0.50000000  0.50000000  1.0
  Mn  Mn2  1  0.49999900  0.50000000  0.00000000  1.0
  Mn  Mn3  1  0.49999900  0.50000000  0.50000100  1.0
  Ni  Ni4  1  0.12500000  0.12499900  0.12500000  1.0
  Ni  Ni5  1  0.87500000  0.87499900  0.87500000  1.0
  O  O6  1  0.74434100  0.74434000  0.74434200  1.0
  O  O7  1  0.25566000  0.25565800  0.73302300  1.0
  O  O8  1  0.25565900  0.73302200  0.25565900  1.0
  O  O9  1  0.73302400  0.25565800  0.25565800  1.0
  O  O10  1  0.74434100  0.26697800  0.74434000  1.0
  O  O11  1  0.26697700  0.74434000  0.74434100  1.0
  O  O12  1  0.25566000  0.25565800  0.25565900  1.0
  O  O13  1  0.74434100  0.74434000  0.26697700  1.0