# generated using pymatgen
data_Tm5Lu(Sc2Sn3)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.66417244
_cell_length_b   8.67012571
_cell_length_c   6.22206507
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.02273006
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm5Lu(Sc2Sn3)2
_chemical_formula_sum   'Tm5 Lu1 Sc4 Sn6'
_cell_volume   404.68596685
_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
  Tm  Tm0  1  0.76214512  0.76187850  0.75000000  1.0
  Tm  Tm1  1  0.23785488  0.99973238  0.75000000  1.0
  Tm  Tm2  1  1.00000000  0.23895668  0.75000000  1.0
  Tm  Tm3  1  0.23813953  0.23813592  0.25000000  1.0
  Tm  Tm4  1  0.76186047  0.99999639  0.25000000  1.0
  Lu  Lu5  1  0.00000000  0.76169061  0.25000000  1.0
  Sc  Sc6  1  0.66646578  0.33317590  0.00006470  1.0
  Sc  Sc7  1  0.33353422  0.66671112  0.00006470  1.0
  Sc  Sc8  1  0.33353422  0.66671112  0.49993530  1.0
  Sc  Sc9  1  0.66646578  0.33317590  0.49993530  1.0
  Sn  Sn10  1  0.39840072  0.39830866  0.75000000  1.0
  Sn  Sn11  1  0.60159928  0.99990794  0.75000000  1.0
  Sn  Sn12  1  1.00000000  0.60154428  0.75000000  1.0
  Sn  Sn13  1  0.60257920  0.60183403  0.25000000  1.0
  Sn  Sn14  1  0.39742080  0.99925483  0.25000000  1.0
  Sn  Sn15  1  0.00000000  0.39898573  0.25000000  1.0