# generated using pymatgen data_Sc2Si(Ni2P)6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.92127756 _cell_length_b 8.92143812 _cell_length_c 3.58406637 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99834494 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2Si(Ni2P)6 _chemical_formula_sum 'Sc2 Si1 Ni12 P6' _cell_volume 247.04486803 _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 0.33333559 0.66669193 0.00000000 1.0 Sc Sc1 1 0.66666886 0.33331992 0.50000000 1.0 Si Si2 1 0.00000213 0.99998427 0.00000000 1.0 Ni Ni3 1 0.62874480 0.06368963 0.00000000 1.0 Ni Ni4 1 0.12328169 0.28395338 0.00000000 1.0 Ni Ni5 1 0.43488924 0.37128954 0.00000000 1.0 Ni Ni6 1 0.93640569 0.56505299 0.00000000 1.0 Ni Ni7 1 0.71604166 0.83936432 0.00000000 1.0 Ni Ni8 1 0.16065360 0.87671226 0.00000000 1.0 Ni Ni9 1 0.87708270 0.08884653 0.50000000 1.0 Ni Ni10 1 0.21184310 0.12296624 0.50000000 1.0 Ni Ni11 1 0.04985853 0.43475789 0.50000000 1.0 Ni Ni12 1 0.56527217 0.61512699 0.50000000 1.0 Ni Ni13 1 0.91106490 0.78808592 0.50000000 1.0 Ni Ni14 1 0.38489144 0.95016036 0.50000000 1.0 P P15 1 0.41265527 0.11780270 0.00000000 1.0 P P16 1 0.88213878 0.29483280 0.00000000 1.0 P P17 1 0.70517433 0.58731528 0.00000000 1.0 P P18 1 0.29257328 0.40977196 0.50000000 1.0 P P19 1 0.11718930 0.70744780 0.50000000 1.0 P P20 1 0.59023092 0.88283530 0.50000000 1.0