# generated using pymatgen
data_SmCo3(Ni3B2)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.96085178
_cell_length_b   5.96085120
_cell_length_c   5.96085119
_cell_angle_alpha   104.45571469
_cell_angle_beta   104.45571933
_cell_angle_gamma   104.45571033
_symmetry_Int_Tables_number   1
_chemical_formula_structural   SmCo3(Ni3B2)3
_chemical_formula_sum   'Sm1 Co3 Ni9 B6'
_cell_volume   187.28872122
_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
  Sm  Sm0  1  0.00000000  0.00000000  0.00000000  1.0
  Co  Co1  1  0.86600578  0.13399422  0.50000000  1.0
  Co  Co2  1  0.13399422  0.50000000  0.86600578  1.0
  Co  Co3  1  0.50000000  0.86600578  0.13399422  1.0
  Ni  Ni4  1  0.86784684  0.50000000  0.13215316  1.0
  Ni  Ni5  1  0.50000000  0.13215316  0.86784684  1.0
  Ni  Ni6  1  0.13215316  0.86784684  0.50000000  1.0
  Ni  Ni7  1  0.81192039  0.54641533  0.54447895  1.0
  Ni  Ni8  1  0.54641533  0.54447895  0.81192039  1.0
  Ni  Ni9  1  0.54447895  0.81192039  0.54641533  1.0
  Ni  Ni10  1  0.18807961  0.45552105  0.45358467  1.0
  Ni  Ni11  1  0.45552105  0.45358467  0.18807961  1.0
  Ni  Ni12  1  0.45358467  0.18807961  0.45552105  1.0
  B  B13  1  0.33238461  0.76563384  0.77220598  1.0
  B  B14  1  0.76563384  0.77220598  0.33238461  1.0
  B  B15  1  0.77220598  0.33238461  0.76563384  1.0
  B  B16  1  0.66761539  0.22779402  0.23436616  1.0
  B  B17  1  0.22779402  0.23436616  0.66761539  1.0
  B  B18  1  0.23436616  0.66761539  0.22779402  1.0