# generated using pymatgen
data_Mn(AlS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.66649326
_cell_length_b   3.66649326
_cell_length_c   36.86887641
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn(AlS2)2
_chemical_formula_sum   'Mn3 Al6 S12'
_cell_volume   429.23222168
_cell_formula_units_Z   3
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  0.33333300  0.66666700  0.60421700  1
  Mn  Mn1  1  0.00000000  0.00000000  0.93755000  1
  Mn  Mn2  1  0.66666700  0.33333300  0.27088300  1
  Al  Al3  1  0.33333300  0.66666700  0.37023300  1
  Al  Al4  1  0.00000000  0.00000000  0.46849000  1
  Al  Al5  1  0.00000000  0.00000000  0.70356700  1
  Al  Al6  1  0.66666700  0.33333300  0.80182300  1
  Al  Al7  1  0.66666700  0.33333300  0.03690000  1
  Al  Al8  1  0.33333300  0.66666700  0.13515600  1
  S  S9  1  0.66666700  0.33333300  0.33828700  1
  S  S10  1  0.33333300  0.66666700  0.49318400  1
  S  S11  1  0.00000000  0.00000000  0.57853000  1
  S  S12  1  0.00000000  0.00000000  0.40759300  1
  S  S13  1  0.33333300  0.66666700  0.67162100  1
  S  S14  1  0.00000000  0.00000000  0.82651700  1
  S  S15  1  0.66666700  0.33333300  0.91186300  1
  S  S16  1  0.66666700  0.33333300  0.74092600  1
  S  S17  1  0.00000000  0.00000000  0.00495400  1
  S  S18  1  0.66666700  0.33333300  0.15985000  1
  S  S19  1  0.33333300  0.66666700  0.24519600  1
  S  S20  1  0.33333300  0.66666700  0.07426000  1
