# generated using pymatgen data_LiTb6Co17P12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.70715806 _cell_length_b 10.46064929 _cell_length_c 12.15875894 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural LiTb6Co17P12 _chemical_formula_sum 'Li1 Tb6 Co17 P12' _cell_volume 471.50792104 _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 Li Li0 1 0.50000000 0.50000000 0.15051395 1.0 Tb Tb1 1 0.00000000 0.50000000 0.52702302 1.0 Tb Tb2 1 0.50000000 0.00000000 0.47872222 1.0 Tb Tb3 1 0.50000000 0.81817483 0.20650939 1.0 Tb Tb4 1 0.50000000 0.18182517 0.20650939 1.0 Tb Tb5 1 0.00000000 0.68326244 0.79447185 1.0 Tb Tb6 1 0.00000000 0.31673756 0.79447185 1.0 Co Co7 1 0.00000000 0.00000000 0.84343923 1.0 Co Co8 1 0.50000000 0.50000000 0.70503317 1.0 Co Co9 1 0.00000000 0.00000000 0.29522888 1.0 Co Co10 1 0.00000000 0.50000000 0.98530211 1.0 Co Co11 1 0.50000000 0.00000000 0.01200225 1.0 Co Co12 1 0.50000000 0.33076872 0.99536272 1.0 Co Co13 1 0.50000000 0.66923128 0.99536272 1.0 Co Co14 1 0.00000000 0.16407184 0.00210989 1.0 Co Co15 1 0.00000000 0.83592816 0.00210989 1.0 Co Co16 1 0.50000000 0.29564384 0.43071937 1.0 Co Co17 1 0.50000000 0.70435616 0.43071937 1.0 Co Co18 1 0.00000000 0.20286383 0.57022472 1.0 Co Co19 1 0.00000000 0.79713617 0.57022472 1.0 Co Co20 1 0.50000000 0.88102079 0.70952948 1.0 Co Co21 1 0.50000000 0.11897921 0.70952948 1.0 Co Co22 1 0.00000000 0.61550745 0.29142104 1.0 Co Co23 1 0.00000000 0.38449255 0.29142104 1.0 P P24 1 0.50000000 0.50000000 0.88463425 1.0 P P25 1 0.00000000 0.00000000 0.11628918 1.0 P P26 1 0.50000000 0.50000000 0.35194657 1.0 P P27 1 0.00000000 0.00000000 0.65725205 1.0 P P28 1 0.50000000 0.30867330 0.61570398 1.0 P P29 1 0.50000000 0.69132670 0.61570398 1.0 P P30 1 0.00000000 0.18927249 0.38608302 1.0 P P31 1 0.00000000 0.81072751 0.38608302 1.0 P P32 1 0.50000000 0.84750715 0.89250755 1.0 P P33 1 0.50000000 0.15249285 0.89250755 1.0 P P34 1 0.00000000 0.65829322 0.10166456 1.0 P P35 1 0.00000000 0.34170678 0.10166456 1.0