# generated using pymatgen data_Sm2Th5Te12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.57369914 _cell_length_b 12.55006984 _cell_length_c 4.37519425 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.63220594 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm2Th5Te12 _chemical_formula_sum 'Sm2 Th5 Te12' _cell_volume 600.11548322 _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 Sm Sm0 1 0.72701072 0.16027063 0.00000000 1.0 Sm Sm1 1 0.84536103 0.56589949 0.00000000 1.0 Th Th2 1 0.43263483 0.27659307 0.00000000 1.0 Th Th3 1 0.55168942 0.71168891 0.50000000 1.0 Th Th4 1 0.29028821 0.84117046 0.50000000 1.0 Th Th5 1 0.15738039 0.44885121 0.50000000 1.0 Th Th6 1 0.99368306 0.99444042 0.00000000 1.0 Te Te7 1 0.74317255 0.74643418 0.00000000 1.0 Te Te8 1 0.24707316 0.99408254 0.00000000 1.0 Te Te9 1 0.00668516 0.25371540 0.00000000 1.0 Te Te10 1 0.49422906 0.86825440 0.00000000 1.0 Te Te11 1 0.13474821 0.62827365 0.00000000 1.0 Te Te12 1 0.37283278 0.50877936 0.00000000 1.0 Te Te13 1 0.86475950 0.38796473 0.50000000 1.0 Te Te14 1 0.21527729 0.21317805 0.50000000 1.0 Te Te15 1 0.99912552 0.78875051 0.50000000 1.0 Te Te16 1 0.78932631 0.00017457 0.50000000 1.0 Te Te17 1 0.52317364 0.13704509 0.50000000 1.0 Te Te18 1 0.61155116 0.47443132 0.50000000 1.0