# generated using pymatgen
data_Er2(NiB2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.43400638
_cell_length_b   5.74862829
_cell_length_c   5.74862808
_cell_angle_alpha   96.59922796
_cell_angle_beta   90.00000100
_cell_angle_gamma   89.99999921
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Er2(NiB2)3
_chemical_formula_sum   'Er2 Ni3 B6'
_cell_volume   112.73076753
_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
  Er  Er0  1  -0.00000001  0.72466666  0.27533431  1.0
  Er  Er1  1  0.00000001  0.27533367  0.72466601  1.0
  Ni  Ni2  1  -0.00000004  0.77321822  0.77321806  1.0
  Ni  Ni3  1  0.00000000  0.22678195  0.22678214  1.0
  Ni  Ni4  1  0.49999985  -0.00000001  0.00000010  1.0
  B  B5  1  0.50000006  0.38716251  0.38716228  1.0
  B  B6  1  0.50000003  0.61283765  0.61283780  1.0
  B  B7  1  0.50000006  0.38353987  0.08401813  1.0
  B  B8  1  0.50000004  0.61646030  0.91598202  1.0
  B  B9  1  0.50000001  0.08401783  0.38353932  1.0
  B  B10  1  0.49999999  0.91598236  0.61646084  1.0