# generated using pymatgen
data_Sm2SiNiBr2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.05134949
_cell_length_b   4.05135033
_cell_length_c   11.04831000
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99998525
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm2SiNiBr2
_chemical_formula_sum   'Sm2 Si1 Ni1 Br2'
_cell_volume   157.04570263
_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  0.17245772  1.0
  Sm  Sm1  1  0.00000000  0.00000000  0.82566257  1.0
  Si  Si2  1  0.66666700  0.33333300  0.99406872  1.0
  Ni  Ni3  1  0.33333300  0.66666700  0.00724882  1.0
  Br  Br4  1  0.33333300  0.66666700  0.65599815  1.0
  Br  Br5  1  0.66666700  0.33333300  0.34456602  1.0