# generated using pymatgen
data_Mg(CrS2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.56141584
_cell_length_b   8.44138533
_cell_length_c   8.40433641
_cell_angle_alpha   45.50670431
_cell_angle_beta   67.10129027
_cell_angle_gamma   67.18400198
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg(CrS2)4
_chemical_formula_sum   'Mg1 Cr4 S8'
_cell_volume   301.15757153
_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  0.62610792  0.61986950  0.62817156  1.0
  Cr  Cr1  1  0.57216741  0.43666441  0.43397307  1.0
  Cr  Cr2  1  0.43278234  0.04933327  0.58484107  1.0
  Cr  Cr3  1  0.05736243  0.43674388  0.43392813  1.0
  Cr  Cr4  1  0.43241468  0.58283608  0.05184395  1.0
  S  S5  1  0.76514523  0.24958748  0.72098563  1.0
  S  S6  1  0.72250761  0.76055504  0.76390316  1.0
  S  S7  1  0.27669678  0.23726586  0.70997030  1.0
  S  S8  1  0.27711752  0.71452510  0.23142101  1.0
  S  S9  1  0.24339508  0.28071536  0.27818760  1.0
  S  S10  1  0.76407236  0.72094268  0.25127585  1.0
  S  S11  1  0.25324591  0.76047108  0.76315809  1.0
  S  S12  1  0.69698572  0.28049025  0.27833857  1.0