# generated using pymatgen
data_ScNb2(SiTc)3
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   6.80692194
_cell_length_b   6.91206496
_cell_length_c   3.31346014
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.49806044
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNb2(SiTc)3
_chemical_formula_sum   'Sc1 Nb2 Si3 Tc3'
_cell_volume   135.68924466
_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  0.40153606  0.00000000  0.50000000  1.0
  Nb  Nb1  1  0.00415080  0.40425636  0.50000000  1.0
  Nb  Nb2  1  0.59989444  0.59574364  0.50000000  1.0
  Si  Si3  1  0.33434144  0.66582023  0.00000000  1.0
  Si  Si4  1  0.66852321  0.33417977  0.00000000  1.0
  Si  Si5  1  0.99854239  0.00000000  0.50000000  1.0
  Tc  Tc6  1  0.74584660  1.00000000  0.00000000  1.0
  Tc  Tc7  1  0.99430124  0.74143542  0.00000000  1.0
  Tc  Tc8  1  0.25286582  0.25856458  0.00000000  1.0