# generated using pymatgen
data_NdZr3Mn8
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.06934003
_cell_length_b   5.06934003
_cell_length_c   8.39055645
_cell_angle_alpha   89.92361215
_cell_angle_beta   90.07638785
_cell_angle_gamma   122.38610050
_symmetry_Int_Tables_number   1
_chemical_formula_structural   NdZr3Mn8
_chemical_formula_sum   'Nd1 Zr3 Mn8'
_cell_volume   182.08371411
_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
  Nd  Nd0  1  0.66661500  0.33338500  0.56120100  1.0
  Zr  Zr1  1  0.33470800  0.66529200  0.43001400  1.0
  Zr  Zr2  1  0.33463500  0.66536500  0.06369000  1.0
  Zr  Zr3  1  0.66506200  0.33493800  0.94051100  1.0
  Mn  Mn4  1  0.99812700  0.00187300  0.49748300  1.0
  Mn  Mn5  1  0.99917400  0.00082600  0.00166100  1.0
  Mn  Mn6  1  0.17354300  0.33656000  0.76090100  1.0
  Mn  Mn7  1  0.17201500  0.82798500  0.76004900  1.0
  Mn  Mn8  1  0.66344000  0.82645700  0.76090100  1.0
  Mn  Mn9  1  0.82964200  0.66677700  0.24054800  1.0
  Mn  Mn10  1  0.82981600  0.17018400  0.24249500  1.0
  Mn  Mn11  1  0.33322300  0.17035800  0.24054800  1.0