# generated using pymatgen
data_Mn3B4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   2.95752836
_cell_length_b   2.97325207
_cell_length_c   12.77058276
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3B4
_chemical_formula_sum   'Mn6 B8'
_cell_volume   112.29782984
_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  0.18631200  1
  Mn  Mn1  1  0.00000000  0.50000000  0.31368800  1
  Mn  Mn2  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn3  1  0.00000000  0.50000000  0.68631200  1
  Mn  Mn4  1  0.50000000  0.00000000  0.81368800  1
  Mn  Mn5  1  0.50000000  0.50000000  0.50000000  1
  B  B6  1  0.00000000  0.00000000  0.43280500  1
  B  B7  1  0.50000000  0.50000000  0.06719500  1
  B  B8  1  0.50000000  0.00000000  0.35744700  1
  B  B9  1  0.00000000  0.50000000  0.14255300  1
  B  B10  1  0.50000000  0.50000000  0.93280500  1
  B  B11  1  0.00000000  0.00000000  0.56719500  1
  B  B12  1  0.00000000  0.50000000  0.85744700  1
  B  B13  1  0.50000000  0.00000000  0.64255300  1
