# generated using pymatgen data_Y2Hf3Si4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.26022797 _cell_length_b 7.26022797 _cell_length_c 13.35038896 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Y2Hf3Si4 _chemical_formula_sum 'Y8 Hf12 Si16' _cell_volume 703.71115396 _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 Y Y0 1 0.99456640 0.34320375 0.21505080 1.0 Y Y1 1 0.00543360 0.65679625 0.71505080 1.0 Y Y2 1 0.15679625 0.49456640 0.46505080 1.0 Y Y3 1 0.50543360 0.84320375 0.03494920 1.0 Y Y4 1 0.84320375 0.50543360 0.96505080 1.0 Y Y5 1 0.49456640 0.15679625 0.53494920 1.0 Y Y6 1 0.34320375 0.99456640 0.78494920 1.0 Y Y7 1 0.65679625 0.00543360 0.28494920 1.0 Hf Hf8 1 0.17488090 0.17488090 0.00000000 1.0 Hf Hf9 1 0.82511910 0.82511910 0.50000000 1.0 Hf Hf10 1 0.32511910 0.67488090 0.25000000 1.0 Hf Hf11 1 0.67488090 0.32511910 0.75000000 1.0 Hf Hf12 1 0.14790268 0.99574013 0.37357102 1.0 Hf Hf13 1 0.85209732 0.00425987 0.87357102 1.0 Hf Hf14 1 0.50425987 0.64790268 0.62357102 1.0 Hf Hf15 1 0.35209732 0.49574013 0.87642898 1.0 Hf Hf16 1 0.49574013 0.35209732 0.12357102 1.0 Hf Hf17 1 0.64790268 0.50425987 0.37642898 1.0 Hf Hf18 1 0.99574013 0.14790268 0.62642898 1.0 Hf Hf19 1 0.00425987 0.85209732 0.12642898 1.0 Si Si20 1 0.36088316 0.29631446 0.31610306 1.0 Si Si21 1 0.63911684 0.70368554 0.81610306 1.0 Si Si22 1 0.20368554 0.86088316 0.56610306 1.0 Si Si23 1 0.13911684 0.79631446 0.93389694 1.0 Si Si24 1 0.79631446 0.13911684 0.06610306 1.0 Si Si25 1 0.86088316 0.20368554 0.43389694 1.0 Si Si26 1 0.29631446 0.36088316 0.68389694 1.0 Si Si27 1 0.70368554 0.63911684 0.18389694 1.0 Si Si28 1 0.29586728 0.04901625 0.18568420 1.0 Si Si29 1 0.70413272 0.95098375 0.68568420 1.0 Si Si30 1 0.45098375 0.79586728 0.43568420 1.0 Si Si31 1 0.20413272 0.54901625 0.06431580 1.0 Si Si32 1 0.54901625 0.20413272 0.93568420 1.0 Si Si33 1 0.79586728 0.45098375 0.56431580 1.0 Si Si34 1 0.04901625 0.29586728 0.81431580 1.0 Si Si35 1 0.95098375 0.70413272 0.31431580 1.0