# generated using pymatgen
data_Tb3Cu3(Ni5B)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.95151686
_cell_length_b   4.95151784
_cell_length_c   10.80291756
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998693
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Tb3Cu3(Ni5B)2
_chemical_formula_sum   'Tb3 Cu3 Ni10 B2'
_cell_volume   229.37620380
_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
  Tb  Tb0  1  0.00000000  0.00000000  0.00012331  1.0
  Tb  Tb1  1  0.00000000  0.00000000  0.33588707  1.0
  Tb  Tb2  1  0.00000000  0.00000000  0.67027237  1.0
  Cu  Cu3  1  0.33333300  0.66666700  0.31740119  1.0
  Cu  Cu4  1  0.66666700  0.33333300  0.31719291  1.0
  Cu  Cu5  1  0.66666700  0.33333300  0.68253007  1.0
  Ni  Ni6  1  0.49956002  0.99912004  0.50054758  1.0
  Ni  Ni7  1  0.49956002  0.50043998  0.50054758  1.0
  Ni  Ni8  1  0.00087996  0.50043998  0.50054758  1.0
  Ni  Ni9  1  0.33333300  0.66666700  0.68056152  1.0
  Ni  Ni10  1  0.50005361  0.00010723  0.13088047  1.0
  Ni  Ni11  1  0.50005361  0.49994639  0.13088047  1.0
  Ni  Ni12  1  0.99989277  0.49994639  0.13088047  1.0
  Ni  Ni13  1  0.49901520  0.99803041  0.86769487  1.0
  Ni  Ni14  1  0.49901520  0.50098480  0.86769487  1.0
  Ni  Ni15  1  0.00196959  0.50098480  0.86769487  1.0
  B  B16  1  0.33333300  0.66666700  0.99966038  1.0
  B  B17  1  0.66666700  0.33333300  0.99899941  1.0