# generated using pymatgen
data_Sc6GaTcNi
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.81171344
_cell_length_b   7.81171444
_cell_length_c   7.81171346
_cell_angle_alpha   104.17971811
_cell_angle_beta   110.94478272
_cell_angle_gamma   113.42621174
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc6GaTcNi
_chemical_formula_sum   'Sc12 Ga2 Tc2 Ni2'
_cell_volume   364.45105922
_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  0.69371694  0.25307322  0.94678916  1.0
  Sc  Sc1  1  0.30628306  0.74692678  0.05321084  1.0
  Sc  Sc2  1  0.69371694  0.74692678  0.44064471  1.0
  Sc  Sc3  1  0.30628306  0.25307322  0.55935529  1.0
  Sc  Sc4  1  0.81412689  0.14668439  0.33255750  1.0
  Sc  Sc5  1  0.81412689  0.48156840  0.66744250  1.0
  Sc  Sc6  1  0.18587311  0.85331561  0.66744250  1.0
  Sc  Sc7  1  0.18587311  0.51843160  0.33255750  1.0
  Sc  Sc8  1  0.60421717  0.78441455  0.81980162  1.0
  Sc  Sc9  1  0.96461193  0.78441455  0.18019838  1.0
  Sc  Sc10  1  0.03538807  0.21558545  0.81980162  1.0
  Sc  Sc11  1  0.39578283  0.21558545  0.18019838  1.0
  Ga  Ga12  1  0.50000000  0.50000000  0.00000000  1.0
  Ga  Ga13  1  0.50000000  0.00000000  0.50000000  1.0
  Tc  Tc14  1  0.81748776  0.50000000  0.31748776  1.0
  Tc  Tc15  1  0.18251224  0.50000000  0.68251224  1.0
  Ni  Ni16  1  0.00000000  0.12332986  0.12332986  1.0
  Ni  Ni17  1  1.00000000  0.87667014  0.87667014  1.0