# generated using pymatgen
data_Th7Tc2Ir
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.98130819
_cell_length_b   9.95146431
_cell_length_c   6.37456437
_cell_angle_alpha   90.00000220
_cell_angle_beta   89.72901150
_cell_angle_gamma   119.90113729
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th7Tc2Ir
_chemical_formula_sum   'Th14 Tc4 Ir2'
_cell_volume   548.88444024
_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
  Th  Th0  1  0.46289759  0.54085364  0.30036019  1.0
  Th  Th1  1  0.07371543  0.53685822  0.29832640  1.0
  Th  Th2  1  0.91957920  0.45978860  0.80321051  1.0
  Th  Th3  1  0.25754125  0.12877063  0.50367000  1.0
  Th  Th4  1  0.54145075  0.07917001  0.80282821  1.0
  Th  Th5  1  0.75283522  0.87641761  0.00438937  1.0
  Th  Th6  1  0.66680793  0.33340346  0.28015874  1.0
  Th  Th7  1  0.12515848  0.87594604  0.00417070  1.0
  Th  Th8  1  0.46289759  0.92204495  0.30036019  1.0
  Th  Th9  1  0.54145075  0.46227974  0.80282821  1.0
  Th  Th10  1  0.87075779  0.12192684  0.50561787  1.0
  Th  Th11  1  0.12515848  0.24921244  0.00417070  1.0
  Th  Th12  1  0.87075779  0.74883196  0.50561787  1.0
  Th  Th13  1  0.33464820  0.66732510  0.78812532  1.0
  Tc  Tc14  1  0.81780451  0.63212749  0.04538026  1.0
  Tc  Tc15  1  0.81780451  0.18567702  0.04538026  1.0
  Tc  Tc16  1  0.62274152  0.81137126  0.54670791  1.0
  Tc  Tc17  1  0.36776162  0.18388031  0.04326061  1.0
  Ir  Ir18  1  0.18411670  0.37479435  0.54971884  1.0
  Ir  Ir19  1  0.18411670  0.80932235  0.54971884  1.0