# generated using pymatgen
data_Mn5B2P
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.51760597
_cell_length_b   5.51760597
_cell_length_c   10.30427068
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn5B2P
_chemical_formula_sum   'Mn20 B8 P4'
_cell_volume   313.70296557
_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  0.33081400  0.83081400  0.36072400  1
  Mn  Mn1  1  0.83081400  0.33081400  0.13927600  1
  Mn  Mn2  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn3  1  0.50000000  0.50000000  0.00000000  1
  Mn  Mn4  1  0.66918600  0.16918600  0.36072400  1
  Mn  Mn5  1  0.83081400  0.66918600  0.36072400  1
  Mn  Mn6  1  0.16918600  0.33081400  0.36072400  1
  Mn  Mn7  1  0.66918600  0.83081400  0.13927600  1
  Mn  Mn8  1  0.33081400  0.16918600  0.13927600  1
  Mn  Mn9  1  0.16918600  0.66918600  0.13927600  1
  Mn  Mn10  1  0.83081400  0.33081400  0.86072400  1
  Mn  Mn11  1  0.33081400  0.83081400  0.63927600  1
  Mn  Mn12  1  0.50000000  0.50000000  0.50000000  1
  Mn  Mn13  1  0.00000000  0.00000000  0.50000000  1
  Mn  Mn14  1  0.16918600  0.66918600  0.86072400  1
  Mn  Mn15  1  0.33081400  0.16918600  0.86072400  1
  Mn  Mn16  1  0.66918600  0.83081400  0.86072400  1
  Mn  Mn17  1  0.16918600  0.33081400  0.63927600  1
  Mn  Mn18  1  0.83081400  0.66918600  0.63927600  1
  Mn  Mn19  1  0.66918600  0.16918600  0.63927600  1
  B  B20  1  0.38113700  0.88113700  0.00000000  1
  B  B21  1  0.11886300  0.38113700  0.00000000  1
  B  B22  1  0.38113700  0.11886300  0.50000000  1
  B  B23  1  0.11886300  0.61886300  0.50000000  1
  B  B24  1  0.88113700  0.38113700  0.50000000  1
  B  B25  1  0.61886300  0.88113700  0.50000000  1
  B  B26  1  0.88113700  0.61886300  0.00000000  1
  B  B27  1  0.61886300  0.11886300  0.00000000  1
  P  P28  1  0.50000000  0.50000000  0.25000000  1
  P  P29  1  0.00000000  0.00000000  0.25000000  1
  P  P30  1  0.00000000  0.00000000  0.75000000  1
  P  P31  1  0.50000000  0.50000000  0.75000000  1
