# generated using pymatgen
data_ScNb(SiTc)2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.32599798
_cell_length_b   6.92590461
_cell_length_c   11.90630065
_cell_angle_alpha   89.58263165
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ScNb(SiTc)2
_chemical_formula_sum   'Sc3 Nb3 Si6 Tc6'
_cell_volume   274.26084424
_cell_formula_units_Z   3
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  0.50000000  0.30033559  0.29944286  1.0
  Sc  Sc1  1  0.50000000  0.29626894  0.69960532  1.0
  Sc  Sc2  1  0.50000000  0.80144630  0.20163278  1.0
  Nb  Nb3  1  0.50000000  0.40444114  0.99891835  1.0
  Nb  Nb4  1  0.50000000  0.90000252  0.50276580  1.0
  Nb  Nb5  1  0.50000000  0.79468901  0.79961859  1.0
  Si  Si6  1  0.00000000  0.99623260  0.66805842  1.0
  Si  Si7  1  0.00000000  0.50219712  0.16428737  1.0
  Si  Si8  1  0.00000000  0.49757470  0.83222134  1.0
  Si  Si9  1  0.00000000  0.00029394  0.33619093  1.0
  Si  Si10  1  0.50000000  0.00329333  0.00122391  1.0
  Si  Si11  1  0.50000000  0.49756397  0.49840721  1.0
  Tc  Tc12  1  0.00000000  0.74294759  0.99487876  1.0
  Tc  Tc13  1  0.00000000  0.23807628  0.50205014  1.0
  Tc  Tc14  1  0.00000000  0.63066213  0.62838130  1.0
  Tc  Tc15  1  0.00000000  0.13553630  0.12452778  1.0
  Tc  Tc16  1  0.00000000  0.12459948  0.87223179  1.0
  Tc  Tc17  1  0.00000000  0.63403506  0.37555634  1.0