# generated using pymatgen
data_MnO2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.86707794
_cell_length_b   4.40041846
_cell_length_c   4.40041846
_cell_angle_alpha   90.00199396
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnO2
_chemical_formula_sum   'Mn2 O4'
_cell_volume   55.51718727
_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  -0.00000000  -0.00000000  0.00000000  1.0
  Mn  Mn1  1  0.50000000  0.50000000  0.50000000  1.0
  O  O2  1  -0.00000000  0.30491615  0.30491615  1.0
  O  O3  1  0.50000000  0.19500250  0.80499750  1.0
  O  O4  1  -0.00000000  0.69508385  0.69508385  1.0
  O  O5  1  0.50000000  0.80499750  0.19500250  1.0