# generated using pymatgen
data_Sc3(Sn2Ru)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.55257345
_cell_length_b   7.55470897
_cell_length_c   7.44722696
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.96362015
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3(Sn2Ru)2
_chemical_formula_sum   'Sc6 Sn8 Ru4'
_cell_volume   368.12643671
_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  0.38101684  0.96578059  0.25000000  1.0
  Sc  Sc1  1  0.58477688  0.61907349  0.25000000  1.0
  Sc  Sc2  1  0.03432629  0.41538719  0.25000000  1.0
  Sc  Sc3  1  0.38109160  0.96416935  0.75000000  1.0
  Sc  Sc4  1  0.58303361  0.61897676  0.75000000  1.0
  Sc  Sc5  1  0.03594802  0.41707575  0.75000000  1.0
  Sn  Sn6  1  0.73471715  0.98516214  0.00009578  1.0
  Sn  Sn7  1  0.25039508  0.26512136  0.49988667  1.0
  Sn  Sn8  1  0.01458494  0.74940278  0.49990402  1.0
  Sn  Sn9  1  0.01458494  0.74940278  0.00009598  1.0
  Sn  Sn10  1  0.25039508  0.26512136  0.00011333  1.0
  Sn  Sn11  1  0.73471715  0.98516214  0.49990422  1.0
  Sn  Sn12  1  0.66669020  0.33334708  0.99933342  1.0
  Sn  Sn13  1  0.66669020  0.33334708  0.50066658  1.0
  Ru  Ru14  1  0.33343054  0.66671104  0.00123013  1.0
  Ru  Ru15  1  0.33343054  0.66671104  0.49876987  1.0
  Ru  Ru16  1  0.00008558  0.00002843  0.25000000  1.0
  Ru  Ru17  1  0.00008236  0.00002262  0.75000000  1.0