# generated using pymatgen
data_Mn(GaS2)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.74488968
_cell_length_b   3.74488968
_cell_length_c   37.20625284
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Mn(GaS2)2
_chemical_formula_sum   'Mn3 Ga6 S12'
_cell_volume   451.88156231
_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  0.00000000  0.00000000  0.23464600  1
  Mn  Mn1  1  0.66666700  0.33333300  0.56797900  1
  Mn  Mn2  1  0.33333300  0.66666700  0.90131200  1
  Ga  Ga3  1  0.66666700  0.33333300  0.33258400  1
  Ga  Ga4  1  0.66666700  0.33333300  0.09826100  1
  Ga  Ga5  1  0.33333300  0.66666700  0.66591700  1
  Ga  Ga6  1  0.33333300  0.66666700  0.43159400  1
  Ga  Ga7  1  0.00000000  0.00000000  0.99925000  1
  Ga  Ga8  1  0.00000000  0.00000000  0.76492700  1
  S  S9  1  0.66666700  0.33333300  0.21148600  1
  S  S10  1  0.00000000  0.00000000  0.12337000  1
  S  S11  1  0.00000000  0.00000000  0.30010700  1
  S  S12  1  0.66666700  0.33333300  0.03688100  1
  S  S13  1  0.33333300  0.66666700  0.54481900  1
  S  S14  1  0.66666700  0.33333300  0.45670300  1
  S  S15  1  0.66666700  0.33333300  0.63344100  1
  S  S16  1  0.33333300  0.66666700  0.37021400  1
  S  S17  1  0.00000000  0.00000000  0.87815200  1
  S  S18  1  0.33333300  0.66666700  0.79003700  1
  S  S19  1  0.33333300  0.66666700  0.96677400  1
  S  S20  1  0.00000000  0.00000000  0.70354700  1
