# generated using pymatgen
data_Cs2MoBr6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.64760671
_cell_length_b   7.64760596
_cell_length_c   7.64761870
_cell_angle_alpha   59.99995140
_cell_angle_beta   59.99994167
_cell_angle_gamma   60.00010693
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Cs2MoBr6
_chemical_formula_sum   'Cs2 Mo1 Br6'
_cell_volume   316.27311579
_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
  Cs  Cs0  1  0.25000000  0.25000000  0.25000000  1.0
  Cs  Cs1  1  0.75000000  0.75000000  0.75000000  1.0
  Mo  Mo2  1  -0.00000000  -0.00000000  0.00000000  1.0
  Br  Br3  1  0.76388427  0.23611573  0.23611573  1.0
  Br  Br4  1  0.23611573  0.76388427  0.76388427  1.0
  Br  Br5  1  0.23611573  0.76388427  0.23611573  1.0
  Br  Br6  1  0.76388427  0.23611573  0.76388427  1.0
  Br  Br7  1  0.23611673  0.23611673  0.76388327  1.0
  Br  Br8  1  0.76388327  0.76388327  0.23611673  1.0