# generated using pymatgen
data_Zr3Mn8Al
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.86891478
_cell_length_b   4.86891478
_cell_length_c   8.12078269
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Zr3Mn8Al
_chemical_formula_sum   'Zr3 Mn8 Al1'
_cell_volume   166.72198299
_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
  Zr  Zr0  1  0.66666700  0.33333300  0.44166400  1
  Zr  Zr1  1  0.66666700  0.33333300  0.06531000  1
  Zr  Zr2  1  0.00000000  0.00000000  0.92341900  1
  Mn  Mn3  1  0.33333300  0.66666700  0.50253800  1
  Mn  Mn4  1  0.33333300  0.66666700  0.00505000  1
  Mn  Mn5  1  0.50438100  0.00876200  0.74522100  1
  Mn  Mn6  1  0.50438100  0.49561900  0.74522100  1
  Mn  Mn7  1  0.99123800  0.49561900  0.74522100  1
  Mn  Mn8  1  0.15997400  0.31994700  0.25421800  1
  Mn  Mn9  1  0.15997400  0.84002600  0.25421800  1
  Mn  Mn10  1  0.68005300  0.84002600  0.25421800  1
  Al  Al11  1  0.00000000  0.00000000  0.56371900  1
