# generated using pymatgen data_Sc8Tc(B8Os)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.50178936 _cell_length_b 8.86336878 _cell_length_c 11.18372700 _cell_angle_alpha 89.96136365 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc8Tc(B8Os)3 _chemical_formula_sum 'Sc8 Tc1 B24 Os3' _cell_volume 347.11653084 _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 Sc Sc0 1 0.00000000 0.81866472 0.08454697 1.0 Sc Sc1 1 0.00000000 0.18429339 0.91136964 1.0 Sc Sc2 1 0.00000000 0.31941140 0.41763993 1.0 Sc Sc3 1 0.00000000 0.67842954 0.58680900 1.0 Sc Sc4 1 0.00000000 0.44377237 0.12703644 1.0 Sc Sc5 1 0.00000000 0.55524264 0.87225659 1.0 Sc Sc6 1 0.00000000 0.94344584 0.37317918 1.0 Sc Sc7 1 0.00000000 0.05708374 0.62696528 1.0 Tc Tc8 1 0.00000000 0.36204803 0.67953118 1.0 B B9 1 0.50000000 0.05328695 0.06477013 1.0 B B10 1 0.50000000 0.94673051 0.93497756 1.0 B B11 1 0.50000000 0.55308185 0.43474853 1.0 B B12 1 0.50000000 0.44724077 0.56503095 1.0 B B13 1 0.50000000 0.25158882 0.07861031 1.0 B B14 1 0.50000000 0.74822989 0.92132045 1.0 B B15 1 0.50000000 0.75119074 0.42134868 1.0 B B16 1 0.50000000 0.24835520 0.57893346 1.0 B B17 1 0.50000000 0.29325016 0.23573658 1.0 B B18 1 0.50000000 0.70654139 0.76482743 1.0 B B19 1 0.50000000 0.79356726 0.26436897 1.0 B B20 1 0.50000000 0.20620618 0.73562889 1.0 B B21 1 0.50000000 0.12960248 0.31746453 1.0 B B22 1 0.50000000 0.87037410 0.68299877 1.0 B B23 1 0.50000000 0.62972751 0.18254677 1.0 B B24 1 0.50000000 0.37043807 0.81709363 1.0 B B25 1 0.50000000 0.47930727 0.28718278 1.0 B B26 1 0.50000000 0.52122559 0.71268137 1.0 B B27 1 0.50000000 0.97921734 0.21255146 1.0 B B28 1 0.50000000 0.02080889 0.78732081 1.0 B B29 1 0.50000000 0.10136381 0.47177880 1.0 B B30 1 0.50000000 0.89768234 0.52813670 1.0 B B31 1 0.50000000 0.60212683 0.02816758 1.0 B B32 1 0.50000000 0.39818632 0.97217903 1.0 Os Os33 1 0.00000000 0.13774681 0.17944057 1.0 Os Os34 1 0.00000000 0.86197414 0.82099231 1.0 Os Os35 1 0.00000000 0.63855212 0.31982874 1.0