# generated using pymatgen data_YTh3(Ga3Rh)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.59004192 _cell_length_b 7.60834229 _cell_length_c 9.48699895 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.65532553 _symmetry_Int_Tables_number 1 _chemical_formula_structural YTh3(Ga3Rh)6 _chemical_formula_sum 'Y1 Th3 Ga18 Rh6' _cell_volume 476.09281317 _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 Y Y0 1 0.33003411 0.00375181 0.75000000 1.0 Th Th1 1 0.99767918 0.66915095 0.25000000 1.0 Th Th2 1 0.00068872 0.33089900 0.75000000 1.0 Th Th3 1 0.66938033 0.99688485 0.25000000 1.0 Ga Ga4 1 0.33777299 0.33321853 0.56634155 1.0 Ga Ga5 1 0.66114070 0.66081260 0.44125464 1.0 Ga Ga6 1 0.66114070 0.66081260 0.05874536 1.0 Ga Ga7 1 0.33777299 0.33321853 0.93365845 1.0 Ga Ga8 1 0.34044438 0.54188367 0.25000000 1.0 Ga Ga9 1 0.65874808 0.45452822 0.75000000 1.0 Ga Ga10 1 0.54188890 0.33739580 0.25000000 1.0 Ga Ga11 1 0.45588178 0.66390009 0.75000000 1.0 Ga Ga12 1 0.00819877 0.33455048 0.07717999 1.0 Ga Ga13 1 0.99909934 0.67144345 0.91982826 1.0 Ga Ga14 1 0.99909934 0.67144345 0.58017174 1.0 Ga Ga15 1 0.33469322 0.00597305 0.42886267 1.0 Ga Ga16 1 0.00819877 0.33455048 0.42282001 1.0 Ga Ga17 1 0.65909901 0.99360493 0.57999319 1.0 Ga Ga18 1 0.65909901 0.99360493 0.92000681 1.0 Ga Ga19 1 0.33469322 0.00597305 0.07113733 1.0 Ga Ga20 1 0.13486617 0.13186870 0.25000000 1.0 Ga Ga21 1 0.87045576 0.86979087 0.75000000 1.0 Rh Rh22 1 0.99776868 0.00019025 0.00028466 1.0 Rh Rh23 1 0.99776868 0.00019025 0.49971534 1.0 Rh Rh24 1 0.67478030 0.32997313 0.00006005 1.0 Rh Rh25 1 0.32741228 0.67020810 0.00030319 1.0 Rh Rh26 1 0.32741228 0.67020810 0.49969681 1.0 Rh Rh27 1 0.67478030 0.32997313 0.49993995 1.0