# generated using pymatgen
data_Mn(CrS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   12.60611239
_cell_length_b   3.35987678
_cell_length_c   5.71428753
_cell_angle_alpha   90.00000000
_cell_angle_beta   115.61836066
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn(CrS2)2
_chemical_formula_sum   'Mn2 Cr4 S8'
_cell_volume   218.23570316
_cell_formula_units_Z   2
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
  Mn  Mn0  1  0.00000000  0.00000000  0.00000000  1
  Mn  Mn1  1  0.50000000  0.50000000  0.00000000  1
  Cr  Cr2  1  0.75630500  0.50000000  0.31211000  1
  Cr  Cr3  1  0.74369500  0.00000000  0.68789000  1
  Cr  Cr4  1  0.25630500  0.00000000  0.31211000  1
  Cr  Cr5  1  0.24369500  0.50000000  0.68789000  1
  S  S6  1  0.85427000  0.50000000  0.01421900  1
  S  S7  1  0.64573000  0.00000000  0.98578100  1
  S  S8  1  0.61721100  0.50000000  0.46178000  1
  S  S9  1  0.88278900  0.00000000  0.53822000  1
  S  S10  1  0.35427000  0.00000000  0.01421900  1
  S  S11  1  0.14573000  0.50000000  0.98578100  1
  S  S12  1  0.11721100  0.00000000  0.46178000  1
  S  S13  1  0.38278900  0.50000000  0.53822000  1
