# generated using pymatgen
data_K2MgNb2(CuS2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.74639353
_cell_length_b   7.56516600
_cell_length_c   9.68070850
_cell_angle_alpha   90.00000000
_cell_angle_beta   102.96773186
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   K2MgNb2(CuS2)4
_chemical_formula_sum   'K2 Mg1 Nb2 Cu4 S8'
_cell_volume   410.11088635
_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
  K  K0  1  0.45896000  0.75000000  0.58646800  1.0
  K  K1  1  0.91221000  0.25000000  0.34280000  1.0
  Mg  Mg2  1  0.13330700  0.75000000  0.94449100  1.0
  Nb  Nb3  1  0.55803700  0.75000000  0.20821500  1.0
  Nb  Nb4  1  0.41348600  0.25000000  0.77371600  1.0
  Cu  Cu5  1  0.48242600  0.49500300  0.99508600  1.0
  Cu  Cu6  1  0.48242600  0.00499700  0.99508600  1.0
  Cu  Cu7  1  0.07006300  0.75000000  0.21578300  1.0
  Cu  Cu8  1  0.91311500  0.25000000  0.78732900  1.0
  S  S9  1  0.73835900  0.75000000  0.00334100  1.0
  S  S10  1  0.72190600  0.25000000  0.98418800  1.0
  S  S11  1  0.89089900  0.75000000  0.40067800  1.0
  S  S12  1  0.59713500  0.25000000  0.58708900  1.0
  S  S13  1  0.16494100  0.49710900  0.78421300  1.0
  S  S14  1  0.31832300  0.50195800  0.20642900  1.0
  S  S15  1  0.16494100  0.00289100  0.78421300  1.0
  S  S16  1  0.31832300  0.99804200  0.20642900  1.0