# generated using pymatgen
data_Mn3B8Mo3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.04571700
_cell_length_b   3.12546000
_cell_length_c   13.18819200
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn3B8Mo3
_chemical_formula_sum   'Mn3 B8 Mo3'
_cell_volume   125.54191634
_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  0.00000000  0.00000000  0.18976200  1.0
  Mn  Mn1  1  0.50000000  0.50000000  0.67649100  1.0
  Mn  Mn2  1  0.50000000  0.50000000  0.31325300  1.0
  B  B3  1  0.50000000  0.00000000  0.42480400  1.0
  B  B4  1  0.00000000  0.50000000  0.93887600  1.0
  B  B5  1  0.00000000  0.50000000  0.07799300  1.0
  B  B6  1  0.50000000  0.00000000  0.56393100  1.0
  B  B7  1  0.00000000  0.00000000  0.35068200  1.0
  B  B8  1  0.50000000  0.50000000  0.86256600  1.0
  B  B9  1  0.50000000  0.50000000  0.15111400  1.0
  B  B10  1  0.00000000  0.00000000  0.63694600  1.0
  Mo  Mo11  1  0.00000000  0.00000000  0.81195900  1.0
  Mo  Mo12  1  0.50000000  0.00000000  0.00752000  1.0
  Mo  Mo13  1  0.00000000  0.50000000  0.49410500  1.0