data_[K2Rb1Mn1I6]
loop_
 _atom_type_symbol
 _atom_type_electronegativity
 _atom_type_radius
 _atom_type_ionic_radius
[
  K  0.8200  2.2000  1.5200
  Rb  0.8200  2.3500  1.6600
  Mn  1.5500  1.4000  0.6483
  I  2.6600  1.4000  1.2733
]
_symmetry_space_group_name_H-M [P1]
_cell_length_a [8.5797]
_cell_length_b [8.6125]
_cell_length_c [8.7708]
_cell_angle_alpha [60.9455]
_cell_angle_beta [89.8883]
_cell_angle_gamma [60.4281]
_symmetry_Int_Tables_number [1]
_chemical_formula_structural [K2RbMnI6]
_chemical_formula_sum '[K2 Rb1 Mn1 I6]'
_cell_volume [468.0330]
_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  0.1837  0.6324  0.5510  1.0
  K  K1  1  0.4668  0.0670  0.4001  1.0
  K  K2  1  0.9803  0.0395  0.9398  1.0
  Mn  Mn3  1  0.6739  0.6518  0.0224  1.0
  I  I4  1  0.3489  0.0728  0.7952  1.0
  I  I5  1  0.4593  0.5430  0.2420  1.0
  I  I6  1  0.5776  0.5530  0.7930  1.0
  I  I7  1  0.7840  0.7552  0.2409  1.0
  I  I8  1  0.8703  0.7850  0.7919  1.0
  I  I9  1  0.9934  0.2234  0.2389  1.0
]