# generated using pymatgen data_DyZr3(Ta3Si4)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.88906779 _cell_length_b 6.89173717 _cell_length_c 12.73163620 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 89.88650949 _symmetry_Int_Tables_number 1 _chemical_formula_structural DyZr3(Ta3Si4)2 _chemical_formula_sum 'Dy2 Zr6 Ta12 Si16' _cell_volume 604.46691190 _cell_formula_units_Z 2 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 Dy Dy0 1 0.99741144 0.66158116 0.03073730 1.0 Dy Dy1 1 0.00258856 0.33841884 0.53073730 1.0 Zr Zr2 1 0.65713509 0.00368950 0.96798140 1.0 Zr Zr3 1 0.16077324 0.49755779 0.78180659 1.0 Zr Zr4 1 0.83922676 0.50244221 0.28180659 1.0 Zr Zr5 1 0.49795882 0.16092529 0.21938718 1.0 Zr Zr6 1 0.50204118 0.83907471 0.71938718 1.0 Zr Zr7 1 0.34286491 0.99631050 0.46798140 1.0 Ta Ta8 1 0.34766590 0.50726530 0.37551870 1.0 Ta Ta9 1 0.84440093 0.99746782 0.37247361 1.0 Ta Ta10 1 0.00534043 0.15286318 0.12708943 1.0 Ta Ta11 1 0.99465957 0.84713682 0.62708943 1.0 Ta Ta12 1 0.65233410 0.49273470 0.87551870 1.0 Ta Ta13 1 0.50383887 0.34806214 0.62429685 1.0 Ta Ta14 1 0.49616113 0.65193786 0.12429685 1.0 Ta Ta15 1 0.15559907 0.00253218 0.87247361 1.0 Ta Ta16 1 0.66827115 0.67264088 0.50005201 1.0 Ta Ta17 1 0.82930734 0.16869687 0.75044208 1.0 Ta Ta18 1 0.17069266 0.83130313 0.25044208 1.0 Ta Ta19 1 0.33172885 0.32735912 0.00005201 1.0 Si Si20 1 0.04447252 0.70676677 0.43630748 1.0 Si Si21 1 0.95552748 0.29323323 0.93630748 1.0 Si Si22 1 0.70047791 0.04438477 0.56350220 1.0 Si Si23 1 0.20284665 0.45499076 0.18750537 1.0 Si Si24 1 0.79715335 0.54500924 0.68750537 1.0 Si Si25 1 0.45551073 0.20136859 0.81291974 1.0 Si Si26 1 0.54448927 0.79863141 0.31291974 1.0 Si Si27 1 0.29952209 0.95561523 0.06350220 1.0 Si Si28 1 0.86362081 0.79290504 0.82073086 1.0 Si Si29 1 0.13637919 0.20709496 0.32073086 1.0 Si Si30 1 0.78896850 0.86819027 0.17989202 1.0 Si Si31 1 0.29421662 0.63836991 0.57198959 1.0 Si Si32 1 0.70578338 0.36163009 0.07198959 1.0 Si Si33 1 0.63181190 0.29303640 0.42736760 1.0 Si Si34 1 0.36818810 0.70696360 0.92736760 1.0 Si Si35 1 0.21103150 0.13180973 0.67989202 1.0