# generated using pymatgen
data_LiTm2Cl5
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.24683576
_cell_length_b   8.24683576
_cell_length_c   7.27911237
_cell_angle_alpha   88.20250102
_cell_angle_beta   88.20250102
_cell_angle_gamma   45.15854656
_symmetry_Int_Tables_number   1
_chemical_formula_structural   LiTm2Cl5
_chemical_formula_sum   'Li2 Tm4 Cl10'
_cell_volume   350.82119262
_cell_formula_units_Z   2
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
  Li  Li0  1  0.50000000  0.00000000  0.00000000  1
  Li  Li1  1  0.00000000  0.50000000  0.50000000  1
  Tm  Tm2  1  0.11695500  0.73550700  0.06464800  1
  Tm  Tm3  1  0.88304500  0.26449300  0.93535200  1
  Tm  Tm4  1  0.26449300  0.88304500  0.43535200  1
  Tm  Tm5  1  0.73550700  0.11695500  0.56464800  1
  Cl  Cl6  1  0.11851700  0.88148300  0.75000000  1
  Cl  Cl7  1  0.85889600  0.73344000  0.83335700  1
  Cl  Cl8  1  0.68558300  0.49220600  0.60203200  1
  Cl  Cl9  1  0.14110400  0.26656000  0.16664300  1
  Cl  Cl10  1  0.31441700  0.50779400  0.39796800  1
  Cl  Cl11  1  0.88148300  0.11851700  0.25000000  1
  Cl  Cl12  1  0.73344000  0.85889600  0.33335700  1
  Cl  Cl13  1  0.49220600  0.68558300  0.10203200  1
  Cl  Cl14  1  0.26656000  0.14110400  0.66664300  1
  Cl  Cl15  1  0.50779400  0.31441700  0.89796800  1
