# generated using pymatgen
data_YbSm(NiB4)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.83599024
_cell_length_b   6.83599051
_cell_length_c   6.83598909
_cell_angle_alpha   112.85325633
_cell_angle_beta   112.85338205
_cell_angle_gamma   102.90019474
_symmetry_Int_Tables_number   1
_chemical_formula_structural   YbSm(NiB4)2
_chemical_formula_sum   'Yb2 Sm2 Ni4 B16'
_cell_volume   243.52600946
_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
  Yb  Yb0  1  0.20522051  0.20522051  1.00000000  1.0
  Yb  Yb1  1  0.79477949  0.79477949  0.00000000  1.0
  Sm  Sm2  1  0.74999322  0.24999322  0.50000000  1.0
  Sm  Sm3  1  0.25000678  0.75000678  0.50000000  1.0
  Ni  Ni4  1  0.50000000  0.27599166  0.77599166  1.0
  Ni  Ni5  1  0.50000000  0.72400834  0.22400834  1.0
  Ni  Ni6  1  0.72398393  0.50000000  0.22398393  1.0
  Ni  Ni7  1  0.27601607  0.50000000  0.77601607  1.0
  B  B8  1  0.11295273  0.27671254  0.38966427  1.0
  B  B9  1  0.88704727  0.72328746  0.61033573  1.0
  B  B10  1  0.88704727  0.27671254  0.16376080  1.0
  B  B11  1  0.11295273  0.72328746  0.83623920  1.0
  B  B12  1  0.72328256  0.88704499  0.61032755  1.0
  B  B13  1  0.27671744  0.11295501  0.38967245  1.0
  B  B14  1  0.72328156  0.11295501  0.83623658  1.0
  B  B15  1  0.27671844  0.88704499  0.16376342  1.0
  B  B16  1  0.41660292  0.41660369  0.53075774  1.0
  B  B17  1  0.88584595  0.88584518  0.46924226  1.0
  B  B18  1  0.58339808  0.11415482  0.00000077  1.0
  B  B19  1  0.11415305  0.58339631  0.99999923  1.0
  B  B20  1  0.58339708  0.58339631  0.46924226  1.0
  B  B21  1  0.11415405  0.11415482  0.53075774  1.0
  B  B22  1  0.88584695  0.41660369  0.00000077  1.0
  B  B23  1  0.41660192  0.88584518  0.99999923  1.0