# generated using pymatgen
data_Sc3Co2Si3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.93160220
_cell_length_b   9.94178194
_cell_length_c   12.82945020
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc3Co2Si3
_chemical_formula_sum   'Sc12 Co8 Si12'
_cell_volume   501.46641021
_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
  Sc  Sc0  1  0.00000000  0.14286900  0.75000000  1
  Sc  Sc1  1  0.00000000  0.42010100  0.61307500  1
  Sc  Sc2  1  0.00000000  0.42010100  0.88692500  1
  Sc  Sc3  1  0.50000000  0.07989900  0.11307500  1
  Sc  Sc4  1  0.50000000  0.35713100  0.25000000  1
  Sc  Sc5  1  0.50000000  0.07989900  0.38692500  1
  Sc  Sc6  1  0.50000000  0.64286900  0.75000000  1
  Sc  Sc7  1  0.50000000  0.92010100  0.61307500  1
  Sc  Sc8  1  0.50000000  0.92010100  0.88692500  1
  Sc  Sc9  1  0.00000000  0.57989900  0.11307500  1
  Sc  Sc10  1  0.00000000  0.85713100  0.25000000  1
  Sc  Sc11  1  0.00000000  0.57989900  0.38692500  1
  Co  Co12  1  0.50000000  0.21554600  0.58320500  1
  Co  Co13  1  0.00000000  0.28445400  0.08320500  1
  Co  Co14  1  0.50000000  0.21554600  0.91679500  1
  Co  Co15  1  0.00000000  0.28445400  0.41679500  1
  Co  Co16  1  0.00000000  0.71554600  0.58320500  1
  Co  Co17  1  0.50000000  0.78445400  0.08320500  1
  Co  Co18  1  0.00000000  0.71554600  0.91679500  1
  Co  Co19  1  0.50000000  0.78445400  0.41679500  1
  Si  Si20  1  0.00000000  0.16398700  0.25000000  1
  Si  Si21  1  0.50000000  0.38634000  0.45911000  1
  Si  Si22  1  0.50000000  0.38634000  0.04089000  1
  Si  Si23  1  0.00000000  0.11366000  0.54089000  1
  Si  Si24  1  0.50000000  0.33601300  0.75000000  1
  Si  Si25  1  0.00000000  0.11366000  0.95911000  1
  Si  Si26  1  0.50000000  0.66398700  0.25000000  1
  Si  Si27  1  0.00000000  0.88634000  0.45911000  1
  Si  Si28  1  0.00000000  0.88634000  0.04089000  1
  Si  Si29  1  0.50000000  0.61366000  0.54089000  1
  Si  Si30  1  0.00000000  0.83601300  0.75000000  1
  Si  Si31  1  0.50000000  0.61366000  0.95911000  1
