# generated using pymatgen
data_Sm2Co2Br
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.91077770
_cell_length_b   3.91077830
_cell_length_c   16.60554392
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000320
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sm2Co2Br
_chemical_formula_sum   'Sm4 Co4 Br2'
_cell_volume   219.94295246
_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
  Sm  Sm0  1  0.00000000  0.00000000  0.10894613  1.0
  Sm  Sm1  1  0.00000000  0.00000000  0.39105387  1.0
  Sm  Sm2  1  0.00000000  0.00000000  0.89105387  1.0
  Sm  Sm3  1  0.00000000  0.00000000  0.60894613  1.0
  Co  Co4  1  0.33333300  0.66666700  0.00254836  1.0
  Co  Co5  1  0.66666700  0.33333300  0.99745164  1.0
  Co  Co6  1  0.33333300  0.66666700  0.49745164  1.0
  Co  Co7  1  0.66666700  0.33333300  0.50254836  1.0
  Br  Br8  1  0.33333300  0.66666700  0.75000000  1.0
  Br  Br9  1  0.66666700  0.33333300  0.25000000  1.0