# generated using pymatgen
data_Sc4MnSi7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.67291415
_cell_length_b   3.84109249
_cell_length_c   14.06098085
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc4MnSi7
_chemical_formula_sum   'Sc4 Mn1 Si7'
_cell_volume   198.37235942
_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
  Sc  Sc0  1  0.00000000  0.00000000  0.11312400  1
  Sc  Sc1  1  0.00000000  0.50000000  0.59626600  1
  Sc  Sc2  1  0.50000000  0.50000000  0.41419400  1
  Sc  Sc3  1  0.50000000  0.00000000  0.90026100  1
  Mn  Mn4  1  0.00000000  0.00000000  0.40292600  1
  Si  Si5  1  0.00000000  0.50000000  0.26849900  1
  Si  Si6  1  0.00000000  0.00000000  0.74277400  1
  Si  Si7  1  0.50000000  0.00000000  0.26863800  1
  Si  Si8  1  0.50000000  0.50000000  0.75313300  1
  Si  Si9  1  0.00000000  0.50000000  0.94366100  1
  Si  Si10  1  0.50000000  0.50000000  0.05425900  1
  Si  Si11  1  0.50000000  0.00000000  0.54226500  1
