# generated using pymatgen
data_Tm3LuNiB14
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.15017859
_cell_length_b   7.15236670
_cell_length_c   7.37304566
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.12166698
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tm3LuNiB14
_chemical_formula_sum   'Tm6 Lu2 Ni2 B28'
_cell_volume   377.06186078
_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
  Tm  Tm0  1  0.19360915  0.33200470  0.00000000  1.0
  Tm  Tm1  1  0.66822375  0.19388644  0.00000000  1.0
  Tm  Tm2  1  0.33177625  0.80611356  0.00000000  1.0
  Tm  Tm3  1  0.69412698  0.16828285  0.50000000  1.0
  Tm  Tm4  1  0.30587302  0.83171715  0.50000000  1.0
  Tm  Tm5  1  0.80639085  0.66799530  0.00000000  1.0
  Lu  Lu6  1  0.83208180  0.69346929  0.50000000  1.0
  Lu  Lu7  1  0.16791820  0.30653071  0.50000000  1.0
  Ni  Ni8  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni9  1  0.50000000  0.50000000  0.50000000  1.0
  B  B10  1  0.17515538  0.03927645  0.23142461  1.0
  B  B11  1  0.96128791  0.17527068  0.23176571  1.0
  B  B12  1  0.03871209  0.82472932  0.23176571  1.0
  B  B13  1  0.67523196  0.46133348  0.26958933  1.0
  B  B14  1  0.32476804  0.53866652  0.26958933  1.0
  B  B15  1  0.82484462  0.96072355  0.23142461  1.0
  B  B16  1  0.53943594  0.67518195  0.26937453  1.0
  B  B17  1  0.46056406  0.32481805  0.26937453  1.0
  B  B18  1  0.82484462  0.96072355  0.76857539  1.0
  B  B19  1  0.03871209  0.82472932  0.76823429  1.0
  B  B20  1  0.96128791  0.17527068  0.76823429  1.0
  B  B21  1  0.32476804  0.53866652  0.73041067  1.0
  B  B22  1  0.67523196  0.46133348  0.73041067  1.0
  B  B23  1  0.17515538  0.03927645  0.76857539  1.0
  B  B24  1  0.46056406  0.32481805  0.73062547  1.0
  B  B25  1  0.53943594  0.67518195  0.73062547  1.0
  B  B26  1  0.08871373  0.58886269  0.25130948  1.0
  B  B27  1  0.41126623  0.08871562  0.25030141  1.0
  B  B28  1  0.58873377  0.91128438  0.25030141  1.0
  B  B29  1  0.91128627  0.41113731  0.25130948  1.0
  B  B30  1  0.91128627  0.41113731  0.74869052  1.0
  B  B31  1  0.58873377  0.91128438  0.74969859  1.0
  B  B32  1  0.41126623  0.08871562  0.74969859  1.0
  B  B33  1  0.08871373  0.58886269  0.74869052  1.0
  B  B34  1  0.00000000  0.00000000  0.38917161  1.0
  B  B35  1  0.50000000  0.50000000  0.11130001  1.0
  B  B36  1  0.00000000  0.00000000  0.61082839  1.0
  B  B37  1  0.50000000  0.50000000  0.88869999  1.0