# generated using pymatgen
data_Sc2Mn3Si
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.91974823
_cell_length_b   4.91974823
_cell_length_c   8.09784649
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc2Mn3Si
_chemical_formula_sum   'Sc4 Mn6 Si2'
_cell_volume   169.74067607
_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
  Sc  Sc0  1  0.33333300  0.66666700  0.56622200  1
  Sc  Sc1  1  0.66666700  0.33333300  0.43377800  1
  Sc  Sc2  1  0.66666700  0.33333300  0.06622200  1
  Sc  Sc3  1  0.33333300  0.66666700  0.93377800  1
  Mn  Mn4  1  0.17460200  0.34920400  0.25000000  1
  Mn  Mn5  1  0.82539800  0.65079600  0.75000000  1
  Mn  Mn6  1  0.65079600  0.82539800  0.25000000  1
  Mn  Mn7  1  0.34920400  0.17460200  0.75000000  1
  Mn  Mn8  1  0.17460200  0.82539800  0.25000000  1
  Mn  Mn9  1  0.82539800  0.17460200  0.75000000  1
  Si  Si10  1  0.00000000  0.00000000  0.00000000  1
  Si  Si11  1  0.00000000  0.00000000  0.50000000  1
