# generated using pymatgen
data_MnSi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   4.52192919
_cell_length_b   4.52192919
_cell_length_c   4.52192919
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnSi
_chemical_formula_sum   'Mn4 Si4'
_cell_volume   92.46370084
_cell_formula_units_Z   4
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  0.86336000  0.63664000  0.36336000  1
  Mn  Mn1  1  0.63664000  0.36336000  0.86336000  1
  Mn  Mn2  1  0.36336000  0.86336000  0.63664000  1
  Mn  Mn3  1  0.13664000  0.13664000  0.13664000  1
  Si  Si4  1  0.15486500  0.34513500  0.65486500  1
  Si  Si5  1  0.34513500  0.65486500  0.15486500  1
  Si  Si6  1  0.65486500  0.15486500  0.34513500  1
  Si  Si7  1  0.84513500  0.84513500  0.84513500  1
