# generated using pymatgen data_Hf20Cu4As7P5 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.62445172 _cell_length_b 10.22489721 _cell_length_c 17.32917159 _cell_angle_alpha 90.01166787 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Hf20Cu4As7P5 _chemical_formula_sum 'Hf20 Cu4 As7 P5' _cell_volume 642.21295639 _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 Hf Hf0 1 0.25000000 0.12412829 0.47914603 1.0 Hf Hf1 1 0.75000000 0.87639671 0.52036173 1.0 Hf Hf2 1 0.75000000 0.62071270 0.02390669 1.0 Hf Hf3 1 0.25000000 0.37744434 0.98113112 1.0 Hf Hf4 1 0.25000000 0.06716617 0.07813836 1.0 Hf Hf5 1 0.75000000 0.93249658 0.92260204 1.0 Hf Hf6 1 0.75000000 0.56703861 0.42115107 1.0 Hf Hf7 1 0.25000000 0.43289173 0.57795754 1.0 Hf Hf8 1 0.25000000 0.48738200 0.26948732 1.0 Hf Hf9 1 0.75000000 0.51197004 0.72745679 1.0 Hf Hf10 1 0.75000000 0.98793841 0.22668306 1.0 Hf Hf11 1 0.25000000 0.01199830 0.77336144 1.0 Hf Hf12 1 0.25000000 0.81404272 0.37149087 1.0 Hf Hf13 1 0.75000000 0.18602985 0.62786664 1.0 Hf Hf14 1 0.75000000 0.32067465 0.12804119 1.0 Hf Hf15 1 0.25000000 0.68550830 0.87280484 1.0 Hf Hf16 1 0.25000000 0.75269688 0.16777641 1.0 Hf Hf17 1 0.75000000 0.24273258 0.83176360 1.0 Hf Hf18 1 0.75000000 0.25789851 0.33039961 1.0 Hf Hf19 1 0.25000000 0.74239350 0.66900607 1.0 Cu Cu20 1 0.25000000 0.37322860 0.41548881 1.0 Cu Cu21 1 0.75000000 0.62733245 0.58330002 1.0 Cu Cu22 1 0.75000000 0.87253224 0.08403231 1.0 Cu Cu23 1 0.25000000 0.12750319 0.91716705 1.0 As As24 1 0.75000000 0.48915635 0.88381405 1.0 As As25 1 0.75000000 0.01118358 0.38233578 1.0 As As26 1 0.25000000 0.98891066 0.61732528 1.0 As As27 1 0.25000000 0.19315203 0.21975366 1.0 As As28 1 0.75000000 0.80761844 0.77978005 1.0 As As29 1 0.75000000 0.69158122 0.27890044 1.0 As As30 1 0.25000000 0.30778941 0.72097920 1.0 P P31 1 0.25000000 0.81211326 0.00918436 1.0 P P32 1 0.75000000 0.18741728 0.99220460 1.0 P P33 1 0.75000000 0.31400793 0.49077706 1.0 P P34 1 0.25000000 0.68632838 0.50825402 1.0 P P35 1 0.25000000 0.51060515 0.11617088 1.0