# generated using pymatgen data_Yb3(SiP2)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 17.04371808 _cell_length_b 6.87475579 _cell_length_c 6.99709347 _cell_angle_alpha 68.20648751 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb3(SiP2)2 _chemical_formula_sum 'Yb12 Si8 P16' _cell_volume 761.26214828 _cell_formula_units_Z 4 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 Yb Yb0 1 0.31660676 0.48959762 0.21850412 1.0 Yb Yb1 1 0.81660676 0.01040238 0.78149588 1.0 Yb Yb2 1 0.68339324 0.51040238 0.78149588 1.0 Yb Yb3 1 0.18339324 0.98959762 0.21850412 1.0 Yb Yb4 1 0.06263255 0.48841084 0.25619950 1.0 Yb Yb5 1 0.56263255 0.01158916 0.74380050 1.0 Yb Yb6 1 0.93736745 0.51158916 0.74380050 1.0 Yb Yb7 1 0.43736745 0.98841084 0.25619950 1.0 Yb Yb8 1 0.55855849 0.49562436 0.26110942 1.0 Yb Yb9 1 0.05855849 0.00437564 0.73889058 1.0 Yb Yb10 1 0.44144151 0.50437564 0.73889058 1.0 Yb Yb11 1 0.94144151 0.99562436 0.26110942 1.0 Si Si12 1 0.87311919 0.47184771 0.20916037 1.0 Si Si13 1 0.37311919 0.02815229 0.79083963 1.0 Si Si14 1 0.12688081 0.52815229 0.79083963 1.0 Si Si15 1 0.62688081 0.97184771 0.20916037 1.0 Si Si16 1 0.74149919 0.08635602 0.31392619 1.0 Si Si17 1 0.24149919 0.41364398 0.68607381 1.0 Si Si18 1 0.25850081 0.91364398 0.68607381 1.0 Si Si19 1 0.75850081 0.58635602 0.31392619 1.0 P P20 1 0.55958605 0.24632279 0.00724152 1.0 P P21 1 0.05958605 0.25367721 0.99275848 1.0 P P22 1 0.44041395 0.75367721 0.99275848 1.0 P P23 1 0.94041395 0.74632279 0.00724152 1.0 P P24 1 0.81488238 0.27810003 0.03934831 1.0 P P25 1 0.31488238 0.22189997 0.96065169 1.0 P P26 1 0.18511762 0.72189997 0.96065169 1.0 P P27 1 0.68511762 0.77810003 0.03934831 1.0 P P28 1 0.93293520 0.25979697 0.49358463 1.0 P P29 1 0.43293520 0.24020303 0.50641537 1.0 P P30 1 0.06706480 0.74020303 0.50641537 1.0 P P31 1 0.56706480 0.75979697 0.49358463 1.0 P P32 1 0.69876348 0.27698102 0.50068099 1.0 P P33 1 0.19876348 0.22301898 0.49931901 1.0 P P34 1 0.30123652 0.72301898 0.49931901 1.0 P P35 1 0.80123652 0.77698102 0.50068099 1.0