# generated using pymatgen
data_MnO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.97728683
_cell_length_b   5.97728683
_cell_length_c   5.97728665
_cell_angle_alpha   58.48809799
_cell_angle_beta   58.48809799
_cell_angle_gamma   58.48810626
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnO2
_chemical_formula_sum   'Mn4 O8'
_cell_volume   145.78399100
_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
  Mn  Mn0  1  0.24558300  0.24558300  0.24558300  1.0
  Mn  Mn1  1  0.62760200  0.11682300  0.62760200  1.0
  Mn  Mn2  1  0.62760200  0.62760200  0.11682300  1.0
  Mn  Mn3  1  0.11682300  0.62760200  0.62760200  1.0
  O  O4  1  0.83819500  0.37287200  0.37287200  1.0
  O  O5  1  0.37287200  0.37287200  0.83819500  1.0
  O  O6  1  0.37287200  0.83819500  0.37287200  1.0
  O  O7  1  0.38607800  0.38607800  0.38607800  1.0
  O  O8  1  0.86087100  0.86087100  0.86087100  1.0
  O  O9  1  0.87621800  0.42162100  0.87621800  1.0
  O  O10  1  0.87621800  0.87621800  0.42162100  1.0
  O  O11  1  0.42162100  0.87621800  0.87621800  1.0