# generated using pymatgen
data_Mg(CrS2)4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.50399062
_cell_length_b   8.43379238
_cell_length_c   8.57209650
_cell_angle_alpha   44.95127774
_cell_angle_beta   67.77242210
_cell_angle_gamma   67.60040279
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mg(CrS2)4
_chemical_formula_sum   'Mg1 Cr4 S8'
_cell_volume   302.86398132
_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  0.63055252  0.61964207  0.63192816  1.0
  Cr  Cr1  1  0.58210531  0.43877396  0.43125119  1.0
  Cr  Cr2  1  0.43176835  0.05359513  0.57831991  1.0
  Cr  Cr3  1  0.05420545  0.44077405  0.42800198  1.0
  Cr  Cr4  1  0.42992460  0.57093871  0.05976271  1.0
  S  S5  1  0.76863175  0.25141313  0.71930240  1.0
  S  S6  1  0.72106076  0.75780685  0.76985316  1.0
  S  S7  1  0.27889122  0.24597887  0.69478596  1.0
  S  S8  1  0.28236184  0.71030597  0.22559208  1.0
  S  S9  1  0.22123066  0.27835014  0.28545112  1.0
  S  S10  1  0.76060598  0.73262739  0.25657654  1.0
  S  S11  1  0.25525907  0.75207758  0.76609921  1.0
  S  S12  1  0.70340350  0.27771614  0.28307359  1.0