# generated using pymatgen
data_MgCu2WS4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   5.39747252
_cell_length_b   5.40322545
_cell_length_c   7.22581636
_cell_angle_alpha   121.10951860
_cell_angle_beta   102.09524005
_cell_angle_gamma   91.55608625
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MgCu2WS4
_chemical_formula_sum   'Mg1 Cu2 W1 S4'
_cell_volume   174.09614336
_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
  Mg  Mg0  1  0.83545455  0.57635840  0.41209985  1.0
  Cu  Cu1  1  0.49864642  0.98444018  0.97682085  1.0
  Cu  Cu2  1  0.99198654  0.48009901  0.97900348  1.0
  W  W3  1  0.01495949  0.01371638  0.02795594  1.0
  S  S4  1  0.81132195  0.88767137  0.21706986  1.0
  S  S5  1  0.33056986  0.40534054  0.21644685  1.0
  S  S6  1  0.14136920  0.60767617  0.74948529  1.0
  S  S7  1  0.72092998  0.02088795  0.74111789  1.0