# generated using pymatgen
data_ThNiOs2C
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   3.97818176
_cell_length_b   5.58442504
_cell_length_c   7.52465700
_cell_angle_alpha   90.00000000
_cell_angle_beta   90.00000000
_cell_angle_gamma   69.11775961
_symmetry_Int_Tables_number   1
_chemical_formula_structural   ThNiOs2C
_chemical_formula_sum   'Th2 Ni2 Os4 C2'
_cell_volume   156.18636565
_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  0.96313180  0.07376487  0.25000100  1.0
  Th  Th1  1  0.03686920  0.92623613  0.75000000  1.0
  Ni  Ni2  1  0.23432586  0.53054181  0.25000100  1.0
  Ni  Ni3  1  0.76567514  0.46945719  0.75000000  1.0
  Os  Os4  1  0.67715975  0.64553446  0.05824985  1.0
  Os  Os5  1  0.67715975  0.64553446  0.44175015  1.0
  Os  Os6  1  0.32284125  0.35446554  0.55824985  1.0
  Os  Os7  1  0.32284125  0.35446554  0.94175115  1.0
  C  C8  1  0.50000100  0.00000000  0.00000000  1.0
  C  C9  1  0.50000100  0.00000000  0.50000000  1.0