# generated using pymatgen
data_Th10CuSn6As
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   9.56094761
_cell_length_b   9.56081226
_cell_length_c   6.55905213
_cell_angle_alpha   89.99968620
_cell_angle_beta   90.00005476
_cell_angle_gamma   120.00087828
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th10CuSn6As
_chemical_formula_sum   'Th10 Cu1 Sn6 As1'
_cell_volume   519.23456973
_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  0.33333628  0.66665958  0.99999976  1.0
  Th  Th1  1  0.66665182  0.33333209  0.50000107  1.0
  Th  Th2  1  0.66666372  0.33334042  0.00000024  1.0
  Th  Th3  1  0.33334818  0.66666791  0.49999893  1.0
  Th  Th4  1  0.26126587  0.00001046  0.25148145  1.0
  Th  Th5  1  0.26127377  0.26127452  0.74851955  1.0
  Th  Th6  1  0.99999098  0.73873246  0.74852057  1.0
  Th  Th7  1  0.00000902  0.26126754  0.25147943  1.0
  Th  Th8  1  0.73872623  0.73872548  0.25148045  1.0
  Th  Th9  1  0.73873413  0.99998954  0.74851855  1.0
  Cu  Cu10  1  0.00000000  0.00000000  0.50000000  1.0
  Sn  Sn11  1  0.61461380  0.00000021  0.25100955  1.0
  Sn  Sn12  1  0.61460878  0.61460980  0.74898782  1.0
  Sn  Sn13  1  0.00000597  0.38539096  0.74898851  1.0
  Sn  Sn14  1  0.99999403  0.61460904  0.25101149  1.0
  Sn  Sn15  1  0.38539122  0.38539020  0.25101218  1.0
  Sn  Sn16  1  0.38538620  0.99999979  0.74899045  1.0
  As  As17  1  0.00000000  0.00000000  0.00000000  1.0