# generated using pymatgen
data_LuMgNi3Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.87151092
_cell_length_b   5.04758107
_cell_length_c   4.87150988
_cell_angle_alpha   61.14733500
_cell_angle_beta   60.00000043
_cell_angle_gamma   61.14732752
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LuMgNi3Ir
_chemical_formula_sum   'Lu1 Mg1 Ni3 Ir1'
_cell_volume   86.14167170
_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
  Lu  Lu0  1  0.50133452  0.49599543  0.50133452  1.0
  Mg  Mg1  1  0.74754618  0.75736145  0.74754618  1.0
  Ni  Ni2  1  0.12527436  0.12295149  0.12527436  1.0
  Ni  Ni3  1  0.62649979  0.12295149  0.12527436  1.0
  Ni  Ni4  1  0.12527436  0.12295149  0.62649979  1.0
  Ir  Ir5  1  0.12407079  0.62778864  0.12407079  1.0