# generated using pymatgen
data_Rb4HfZr7Se16
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.58523739
_cell_length_b   7.61463047
_cell_length_c   17.00573220
_cell_angle_alpha   89.94860518
_cell_angle_beta   90.00045440
_cell_angle_gamma   90.01506469
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Rb4HfZr7Se16
_chemical_formula_sum   'Rb4 Hf1 Zr7 Se16'
_cell_volume   852.73760255
_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
  Rb  Rb0  1  0.34975671  0.00005754  0.99974677  1.0
  Rb  Rb1  1  0.65024329  0.49994246  0.50025323  1.0
  Rb  Rb2  1  0.02725113  0.00096414  0.49975858  1.0
  Rb  Rb3  1  0.97274887  0.49903586  0.00024142  1.0
  Hf  Hf4  1  0.50000000  0.25000000  0.25000000  1.0
  Zr  Zr5  1  0.00133297  0.99890151  0.24922097  1.0
  Zr  Zr6  1  0.00140617  0.99990481  0.75082043  1.0
  Zr  Zr7  1  0.99866703  0.50109849  0.25077903  1.0
  Zr  Zr8  1  0.99859383  0.50009519  0.74917957  1.0
  Zr  Zr9  1  0.50000000  0.75000000  0.75000000  1.0
  Zr  Zr10  1  0.50000000  0.75000000  0.25000000  1.0
  Zr  Zr11  1  0.50000000  0.25000000  0.75000000  1.0
  Se  Se12  1  0.82914409  0.24870686  0.34328251  1.0
  Se  Se13  1  0.83429677  0.75141368  0.65542184  1.0
  Se  Se14  1  0.16427306  0.74915612  0.15510464  1.0
  Se  Se15  1  0.16545262  0.25115308  0.84455723  1.0
  Se  Se16  1  0.17085591  0.25129314  0.15671749  1.0
  Se  Se17  1  0.16570323  0.74858632  0.84457816  1.0
  Se  Se18  1  0.83572694  0.75084388  0.34489536  1.0
  Se  Se19  1  0.83454738  0.24884692  0.65544277  1.0
  Se  Se20  1  0.66698554  0.00381315  0.15719585  1.0
  Se  Se21  1  0.66874058  0.99994897  0.84359125  1.0
  Se  Se22  1  0.33301446  0.49618685  0.34280415  1.0
  Se  Se23  1  0.33125942  0.50005103  0.65640875  1.0
  Se  Se24  1  0.33905303  0.00282608  0.34249788  1.0
  Se  Se25  1  0.33724732  0.00020543  0.65692815  1.0
  Se  Se26  1  0.66094697  0.49717392  0.15750212  1.0
  Se  Se27  1  0.66275268  0.49979457  0.84307185  1.0