# generated using pymatgen
data_Mn29H2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.50157917
_cell_length_b   7.50157917
_cell_length_c   7.49444010
_cell_angle_alpha   70.50146050
_cell_angle_beta   70.50146050
_cell_angle_gamma   109.37167339
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn29H2
_chemical_formula_sum   'Mn29 H2'
_cell_volume   324.83486442
_cell_formula_units_Z   1
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  0.00001400  0.00001400  0.00009500  1.0
  Mn  Mn1  1  0.82151700  0.62840700  0.37220100  1.0
  Mn  Mn2  1  0.62840700  0.82151700  0.37220100  1.0
  Mn  Mn3  1  0.62738700  0.62738700  0.17767100  1.0
  Mn  Mn4  1  0.17920600  0.80657300  0.19252300  1.0
  Mn  Mn5  1  0.37159100  0.99910200  0.80878700  1.0
  Mn  Mn6  1  0.37303200  0.19483500  0.00004000  1.0
  Mn  Mn7  1  0.00055500  0.19179400  0.62753300  1.0
  Mn  Mn8  1  0.19179400  0.00055500  0.62753300  1.0
  Mn  Mn9  1  0.80564500  0.80564500  0.82122100  1.0
  Mn  Mn10  1  0.99910200  0.37159100  0.80878700  1.0
  Mn  Mn11  1  0.80657300  0.17920600  0.19252300  1.0
  Mn  Mn12  1  0.19483500  0.37303200  0.00004000  1.0
  Mn  Mn13  1  0.29573700  0.61557100  0.38455600  1.0
  Mn  Mn14  1  0.61557100  0.29573700  0.38455600  1.0
  Mn  Mn15  1  0.61162300  0.61162300  0.71096000  1.0
  Mn  Mn16  1  0.70435600  0.31995500  0.68024200  1.0
  Mn  Mn17  1  0.38726400  0.00002400  0.31951300  1.0
  Mn  Mn18  1  0.38830000  0.67730400  0.00008000  1.0
  Mn  Mn19  1  0.99988500  0.68014000  0.61291700  1.0
  Mn  Mn20  1  0.68014000  0.99988500  0.61291700  1.0
  Mn  Mn21  1  0.32293900  0.32293900  0.28872400  1.0
  Mn  Mn22  1  0.00002400  0.38726400  0.31951300  1.0
  Mn  Mn23  1  0.31995500  0.70435600  0.68024200  1.0
  Mn  Mn24  1  0.67730400  0.38830000  0.00008000  1.0
  Mn  Mn25  1  0.36156600  0.36156600  0.63898300  1.0
  Mn  Mn26  1  0.63816800  0.99935700  0.00037500  1.0
  Mn  Mn27  1  0.00010900  0.00010900  0.36105800  1.0
  Mn  Mn28  1  0.99935700  0.63816800  0.00037500  1.0
  H  H29  1  0.99993400  0.46011100  0.53987700  1.0
  H  H30  1  0.46011100  0.99993400  0.53987700  1.0