# generated using pymatgen
data_YTm3(NiB4)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.76643070
_cell_length_b   6.76643127
_cell_length_c   6.76643088
_cell_angle_alpha   113.01599115
_cell_angle_beta   113.01599695
_cell_angle_gamma   102.59299410
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YTm3(NiB4)4
_chemical_formula_sum   'Y1 Tm3 Ni4 B16'
_cell_volume   235.94810724
_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
  Y  Y0  1  0.25000000  0.75000000  0.50000000  1.0
  Tm  Tm1  1  0.79545922  0.79545922  0.00000000  1.0
  Tm  Tm2  1  0.20454078  0.20454078  1.00000000  1.0
  Tm  Tm3  1  0.75000000  0.25000000  0.50000000  1.0
  Ni  Ni4  1  0.27169702  0.49934467  0.77235235  1.0
  Ni  Ni5  1  0.72699332  0.49934467  0.22764765  1.0
  Ni  Ni6  1  0.50065533  0.72830298  0.22764765  1.0
  Ni  Ni7  1  0.50065533  0.27300668  0.77235235  1.0
  B  B8  1  0.27543860  0.11129204  0.38724332  1.0
  B  B9  1  0.72404872  0.88819529  0.61275668  1.0
  B  B10  1  0.27543860  0.88819529  0.16414557  1.0
  B  B11  1  0.72404872  0.11129204  0.83585443  1.0
  B  B12  1  0.11180471  0.72456140  0.83585443  1.0
  B  B13  1  0.88870796  0.27595128  0.16414557  1.0
  B  B14  1  0.11180471  0.27595128  0.38724332  1.0
  B  B15  1  0.88870796  0.72456140  0.61275668  1.0
  B  B16  1  0.11389437  0.11544861  0.53484743  1.0
  B  B17  1  0.58060117  0.57904694  0.46515257  1.0
  B  B18  1  0.11389437  0.57904694  0.99844577  1.0
  B  B19  1  0.58060117  0.11544861  0.00155423  1.0
  B  B20  1  0.88455139  0.88610563  0.46515257  1.0
  B  B21  1  0.42095306  0.41939883  0.53484743  1.0
  B  B22  1  0.88455139  0.41939883  0.99844577  1.0
  B  B23  1  0.42095306  0.88610563  0.00155423  1.0