# generated using pymatgen
data_Th2Mg3Ni9As7
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.62069874
_cell_length_b   9.62069970
_cell_length_c   3.95884800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   119.99999672
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2Mg3Ni9As7
_chemical_formula_sum   'Th2 Mg3 Ni9 As7'
_cell_volume   317.33118109
_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
  Th  Th0  1  0.33333300  0.66666700  0.00000000  1.0
  Th  Th1  1  0.00000000  0.00000000  0.50000000  1.0
  Mg  Mg2  1  0.76863487  0.21446109  0.50000000  1.0
  Mg  Mg3  1  0.78553891  0.55417278  0.50000000  1.0
  Mg  Mg4  1  0.44582722  0.23136513  0.50000000  1.0
  Ni  Ni5  1  0.01744775  0.26034829  0.00000000  1.0
  Ni  Ni6  1  0.73965171  0.75709847  0.00000000  1.0
  Ni  Ni7  1  0.24290153  0.98255225  0.00000000  1.0
  Ni  Ni8  1  0.53085447  0.04264180  0.00000000  1.0
  Ni  Ni9  1  0.95735820  0.48821267  0.00000000  1.0
  Ni  Ni10  1  0.51178733  0.46914553  0.00000000  1.0
  Ni  Ni11  1  0.61051153  0.89413657  0.50000000  1.0
  Ni  Ni12  1  0.10586343  0.71637295  0.50000000  1.0
  Ni  Ni13  1  0.28362705  0.38948847  0.50000000  1.0
  As  As14  1  0.76114169  0.01194535  0.00000000  1.0
  As  As15  1  0.98805465  0.74919834  0.00000000  1.0
  As  As16  1  0.25080166  0.23885831  0.00000000  1.0
  As  As17  1  0.37205959  0.92741958  0.50000000  1.0
  As  As18  1  0.07258042  0.44464001  0.50000000  1.0
  As  As19  1  0.55535999  0.62794041  0.50000000  1.0
  As  As20  1  0.66666700  0.33333300  0.00000000  1.0