# generated using pymatgen
data_Sc12GaTcNi4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   7.69607044
_cell_length_b   7.69607025
_cell_length_c   7.69607020
_cell_angle_alpha   111.14418010
_cell_angle_beta   109.97350717
_cell_angle_gamma   107.31940193
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Sc12GaTcNi4
_chemical_formula_sum   'Sc12 Ga1 Tc1 Ni4'
_cell_volume   350.49394705
_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  0.42661653  0.23321713  0.19339840  1.0
  Sc  Sc1  1  0.57338347  0.76678287  0.80660160  1.0
  Sc  Sc2  1  0.03981873  0.23321713  0.80660160  1.0
  Sc  Sc3  1  0.96018127  0.76678287  0.19339840  1.0
  Sc  Sc4  1  0.18123005  0.27417141  0.45540146  1.0
  Sc  Sc5  1  0.81876995  0.72582859  0.54459854  1.0
  Sc  Sc6  1  0.18123005  0.72582859  0.90705864  1.0
  Sc  Sc7  1  0.81876995  0.27417141  0.09294136  1.0
  Sc  Sc8  1  0.32363297  0.62061147  0.29697850  1.0
  Sc  Sc9  1  0.67636703  0.37938853  0.70302150  1.0
  Sc  Sc10  1  0.32363297  0.02665447  0.70302150  1.0
  Sc  Sc11  1  0.67636703  0.97334553  0.29697850  1.0
  Ga  Ga12  1  0.50000000  0.50000000  0.00000000  1.0
  Tc  Tc13  1  0.00000000  0.00000000  0.00000000  1.0
  Ni  Ni14  1  0.35386651  1.00000000  0.35386651  1.0
  Ni  Ni15  1  0.64613349  0.00000000  0.64613349  1.0
  Ni  Ni16  1  0.12370746  0.62370746  0.50000000  1.0
  Ni  Ni17  1  0.87629254  0.37629254  0.50000000  1.0