# generated using pymatgen data_Yb3Hf5(Si4Mo3)4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.59976594 _cell_length_b 6.78272158 _cell_length_c 12.68229991 _cell_angle_alpha 90.22476404 _cell_angle_beta 89.88267212 _cell_angle_gamma 90.19998321 _symmetry_Int_Tables_number 1 _chemical_formula_structural Yb3Hf5(Si4Mo3)4 _chemical_formula_sum 'Yb3 Hf5 Si16 Mo12' _cell_volume 567.70622680 _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 Yb Yb0 1 0.99537943 0.16190183 0.08920977 1.0 Yb Yb1 1 0.00193689 0.83592177 0.91099589 1.0 Yb Yb2 1 0.50242509 0.66584553 0.90932561 1.0 Hf Hf3 1 0.00272480 0.83175203 0.59315963 1.0 Hf Hf4 1 0.49637157 0.32829028 0.09877096 1.0 Hf Hf5 1 0.99597716 0.16819272 0.40711335 1.0 Hf Hf6 1 0.49449821 0.33257424 0.40766123 1.0 Hf Hf7 1 0.50325503 0.67044434 0.59324161 1.0 Si Si8 1 0.03491233 0.12817641 0.74816895 1.0 Si Si9 1 0.96756468 0.87053154 0.25117823 1.0 Si Si10 1 0.46693630 0.62696592 0.25074932 1.0 Si Si11 1 0.53493189 0.37485447 0.74668856 1.0 Si Si12 1 0.29958234 0.86631958 0.74914680 1.0 Si Si13 1 0.70038058 0.13486420 0.25171859 1.0 Si Si14 1 0.19887973 0.36236987 0.25150240 1.0 Si Si15 1 0.80014718 0.63737027 0.74912422 1.0 Si Si16 1 0.16656892 0.45962551 0.54143645 1.0 Si Si17 1 0.83432258 0.54143362 0.45735710 1.0 Si Si18 1 0.33366829 0.95849341 0.45714855 1.0 Si Si19 1 0.83646684 0.53604026 0.04842233 1.0 Si Si20 1 0.66663360 0.04112381 0.54089635 1.0 Si Si21 1 0.15880358 0.45975842 0.95383938 1.0 Si Si22 1 0.65494988 0.04386577 0.95398431 1.0 Si Si23 1 0.34478682 0.96185969 0.04831534 1.0 Mo Mo24 1 0.16532394 0.50644856 0.74351352 1.0 Mo Mo25 1 0.83203428 0.49000365 0.25466647 1.0 Mo Mo26 1 0.33468878 0.01108544 0.25416924 1.0 Mo Mo27 1 0.66541353 0.99553360 0.74248284 1.0 Mo Mo28 1 0.33157306 0.16588161 0.61971104 1.0 Mo Mo29 1 0.67034030 0.83563174 0.37824676 1.0 Mo Mo30 1 0.17195608 0.66170594 0.37882394 1.0 Mo Mo31 1 0.66892675 0.83193181 0.12765390 1.0 Mo Mo32 1 0.83192216 0.33617375 0.61944037 1.0 Mo Mo33 1 0.33422897 0.17376598 0.87298704 1.0 Mo Mo34 1 0.83013162 0.33145319 0.87128825 1.0 Mo Mo35 1 0.17135877 0.66180525 0.12786570 1.0