# generated using pymatgen
data_Sc3MnAs2Ir3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.55414605
_cell_length_b   6.55414695
_cell_length_c   3.97610122
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   120.00000547
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3MnAs2Ir3
_chemical_formula_sum   'Sc3 Mn1 As2 Ir3'
_cell_volume   147.91776257
_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  1.00000000  0.41400366  0.50000000  1.0
  Sc  Sc1  1  0.58599634  0.58599634  0.50000000  1.0
  Sc  Sc2  1  0.41400366  1.00000000  0.50000000  1.0
  Mn  Mn3  1  0.00000000  0.00000000  0.50000000  1.0
  As  As4  1  0.66666700  0.33333300  0.00000000  1.0
  As  As5  1  0.33333300  0.66666700  0.00000000  1.0
  Ir  Ir6  1  0.00000000  0.75820270  0.00000000  1.0
  Ir  Ir7  1  0.24179730  0.24179730  0.00000000  1.0
  Ir  Ir8  1  0.75820270  0.00000000  0.00000000  1.0