# generated using pymatgen
data_MnB4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.32656370
_cell_length_b   5.42171991
_cell_length_c   5.45504007
_cell_angle_alpha   114.81670295
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnB4
_chemical_formula_sum   'Mn4 B16'
_cell_volume   142.98913167
_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  0.49941368  0.72866789  0.22230396  1.0
  Mn  Mn1  1  0.99941368  0.27133211  0.27769604  1.0
  Mn  Mn2  1  0.50058632  0.27133211  0.77769604  1.0
  Mn  Mn3  1  0.00058632  0.72866789  0.72230396  1.0
  B  B4  1  0.68136470  0.12939530  0.37449447  1.0
  B  B5  1  0.18136470  0.87060470  0.12550553  1.0
  B  B6  1  0.31863530  0.87060470  0.62550553  1.0
  B  B7  1  0.81863530  0.12939530  0.87449447  1.0
  B  B8  1  0.68707788  0.63521766  0.86199339  1.0
  B  B9  1  0.18707788  0.36478234  0.63800661  1.0
  B  B10  1  0.31292212  0.36478234  0.13800661  1.0
  B  B11  1  0.81292212  0.63521766  0.36199339  1.0
  B  B12  1  0.62989098  0.32931758  0.17563369  1.0
  B  B13  1  0.12989098  0.67068242  0.32436631  1.0
  B  B14  1  0.37010902  0.67068242  0.82436631  1.0
  B  B15  1  0.87010902  0.32931758  0.67563369  1.0
  B  B16  1  0.62929126  0.83672684  0.65821336  1.0
  B  B17  1  0.12929126  0.16327316  0.84178664  1.0
  B  B18  1  0.37070874  0.16327316  0.34178664  1.0
  B  B19  1  0.87070874  0.83672684  0.15821336  1.0