# generated using pymatgen
data_MnSiIr
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.86645540
_cell_length_b   6.19520138
_cell_length_c   7.16274726
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   MnSiIr
_chemical_formula_sum   'Mn4 Si4 Ir4'
_cell_volume   171.57265039
_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  0.75000000  0.97373952  0.17880258  1.0
  Mn  Mn1  1  0.25000000  0.02626048  0.82119742  1.0
  Mn  Mn2  1  0.75000000  0.47373952  0.32119742  1.0
  Mn  Mn3  1  0.25000000  0.52626048  0.67880258  1.0
  Si  Si4  1  0.25000000  0.27950834  0.12634113  1.0
  Si  Si5  1  0.75000000  0.72049166  0.87365887  1.0
  Si  Si6  1  0.25000000  0.77950834  0.37365887  1.0
  Si  Si7  1  0.75000000  0.22049166  0.62634113  1.0
  Ir  Ir8  1  0.25000000  0.66343267  0.06072307  1.0
  Ir  Ir9  1  0.75000000  0.33656733  0.93927693  1.0
  Ir  Ir10  1  0.25000000  0.16343267  0.43927693  1.0
  Ir  Ir11  1  0.75000000  0.83656733  0.56072307  1.0