# generated using pymatgen
data_Mn3B4Mo3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.09196002
_cell_length_b   8.13672700
_cell_length_c   7.98949238
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3B4Mo3
_chemical_formula_sum   'Mn6 B8 Mo6'
_cell_volume   201.00312135
_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  0.74856600  0.24838300  0.00000000  1
  Mn  Mn1  1  0.74856600  0.75161700  0.00000000  1
  Mn  Mn2  1  0.67348700  0.00000000  0.50000000  1
  Mn  Mn3  1  0.24856600  0.74838300  0.00000000  1
  Mn  Mn4  1  0.24856600  0.25161700  0.00000000  1
  Mn  Mn5  1  0.17348700  0.50000000  0.50000000  1
  B  B6  1  0.61342800  0.50000000  0.00000000  1
  B  B7  1  0.87232300  0.00000000  0.00000000  1
  B  B8  1  0.01181300  0.38895400  0.00000000  1
  B  B9  1  0.51181300  0.11104600  0.00000000  1
  B  B10  1  0.11342800  0.00000000  0.00000000  1
  B  B11  1  0.37232300  0.50000000  0.00000000  1
  B  B12  1  0.51181300  0.88895400  0.00000000  1
  B  B13  1  0.01181300  0.61104600  0.00000000  1
  Mo  Mo14  1  0.82709700  0.50000000  0.50000000  1
  Mo  Mo15  1  0.49645400  0.32210800  0.50000000  1
  Mo  Mo16  1  0.99645400  0.17789200  0.50000000  1
  Mo  Mo17  1  0.32709700  0.00000000  0.50000000  1
  Mo  Mo18  1  0.99645400  0.82210800  0.50000000  1
  Mo  Mo19  1  0.49645400  0.67789200  0.50000000  1
