# generated using pymatgen
data_Th5Sn4
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   8.31384500
_cell_length_b   8.44376200
_cell_length_c   15.84908800
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   90.00000000
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th5Sn4
_chemical_formula_sum   'Th20 Sn16'
_cell_volume   1112.60801397
_cell_formula_units_Z   4
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  0.37216100  0.83755100  0.87794100  1.0
  Th  Th1  1  0.87216100  0.66244900  0.62205900  1.0
  Th  Th2  1  0.62783900  0.16244900  0.37794100  1.0
  Th  Th3  1  0.12783900  0.33755100  0.12205900  1.0
  Th  Th4  1  0.62783900  0.16244900  0.12205900  1.0
  Th  Th5  1  0.12783900  0.33755100  0.37794100  1.0
  Th  Th6  1  0.37216100  0.83755100  0.62205900  1.0
  Th  Th7  1  0.87216100  0.66244900  0.87794100  1.0
  Th  Th8  1  0.51925000  0.32044000  0.90080400  1.0
  Th  Th9  1  0.01925000  0.17956000  0.59919600  1.0
  Th  Th10  1  0.48075000  0.67956000  0.40080400  1.0
  Th  Th11  1  0.98075000  0.82044000  0.09919600  1.0
  Th  Th12  1  0.48075000  0.67956000  0.09919600  1.0
  Th  Th13  1  0.98075000  0.82044000  0.40080400  1.0
  Th  Th14  1  0.51925000  0.32044000  0.59919600  1.0
  Th  Th15  1  0.01925000  0.17956000  0.90080400  1.0
  Th  Th16  1  0.19210500  0.49821500  0.75000000  1.0
  Th  Th17  1  0.69210500  0.00178500  0.75000000  1.0
  Th  Th18  1  0.80789500  0.50178500  0.25000000  1.0
  Th  Th19  1  0.30789500  0.99821500  0.25000000  1.0
  Sn  Sn20  1  0.28838900  0.03290800  0.04271000  1.0
  Sn  Sn21  1  0.78838900  0.46709200  0.45729000  1.0
  Sn  Sn22  1  0.71161100  0.96709200  0.54271000  1.0
  Sn  Sn23  1  0.21161100  0.53290800  0.95729000  1.0
  Sn  Sn24  1  0.71161100  0.96709200  0.95729000  1.0
  Sn  Sn25  1  0.21161100  0.53290800  0.54271000  1.0
  Sn  Sn26  1  0.28838900  0.03290800  0.45729000  1.0
  Sn  Sn27  1  0.78838900  0.46709200  0.04271000  1.0
  Sn  Sn28  1  0.56581900  0.61151400  0.75000000  1.0
  Sn  Sn29  1  0.06581900  0.88848600  0.75000000  1.0
  Sn  Sn30  1  0.43418100  0.38848600  0.25000000  1.0
  Sn  Sn31  1  0.93418100  0.11151400  0.25000000  1.0
  Sn  Sn32  1  0.32223300  0.14030400  0.75000000  1.0
  Sn  Sn33  1  0.82223300  0.35969600  0.75000000  1.0
  Sn  Sn34  1  0.67776700  0.85969600  0.25000000  1.0
  Sn  Sn35  1  0.17776700  0.64030400  0.25000000  1.0