# generated using pymatgen
data_TmAlFe
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.34470252
_cell_length_b   5.32762235
_cell_length_c   8.50855300
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.89390137
_symmetry_Int_Tables_number   1
_chemical_formula_structural   TmAlFe
_chemical_formula_sum   'Tm4 Al4 Fe4'
_cell_volume   210.04223479
_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
  Tm  Tm0  1  0.66657700  0.33328400  0.56512000  1.0
  Tm  Tm1  1  0.32706000  0.66354700  0.44808500  1.0
  Tm  Tm2  1  0.32706000  0.66354700  0.05191500  1.0
  Tm  Tm3  1  0.66657700  0.33328400  0.93488000  1.0
  Al  Al4  1  0.67065000  0.83531800  0.75000000  1.0
  Al  Al5  1  0.83579800  0.67250000  0.25000000  1.0
  Al  Al6  1  0.83580200  0.16331400  0.25000000  1.0
  Al  Al7  1  0.32898200  0.16449900  0.25000000  1.0
  Fe  Fe8  1  0.01153900  0.00576400  0.51057300  1.0
  Fe  Fe9  1  0.01153900  0.00576400  0.98942700  1.0
  Fe  Fe10  1  0.15919600  0.32817000  0.75000000  1.0
  Fe  Fe11  1  0.15922000  0.83101000  0.75000000  1.0