# generated using pymatgen
data_Th2CuC2
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.80599018
_cell_length_b   3.80599032
_cell_length_c   6.75922043
_cell_angle_alpha   106.35216640
_cell_angle_beta   106.35216614
_cell_angle_gamma   90.00000555
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Th2CuC2
_chemical_formula_sum   'Th2 Cu1 C2'
_cell_volume   89.81549103
_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  0.64925976  0.64925976  0.29852252  1.0
  Th  Th1  1  0.35073824  0.35073824  0.70147748  1.0
  Cu  Cu2  1  0.00000000  0.00000000  0.00000000  1.0
  C  C3  1  0.15722714  0.15722714  0.31445327  1.0
  C  C4  1  0.84277186  0.84277186  0.68554673  1.0