# generated using pymatgen data_Zr9VRe3Ni _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.73168399 _cell_length_b 8.73167311 _cell_length_c 8.34907244 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00035209 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr9VRe3Ni _chemical_formula_sum 'Zr18 V2 Re6 Ni2' _cell_volume 551.26801918 _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 Zr Zr0 1 0.19710410 0.80291258 0.44193434 1.0 Zr Zr1 1 0.19709341 0.39418983 0.44192265 1.0 Zr Zr2 1 0.60580762 0.80290966 0.44192808 1.0 Zr Zr3 1 0.80289590 0.19708742 0.55806566 1.0 Zr Zr4 1 0.80290659 0.60581017 0.55807735 1.0 Zr Zr5 1 0.39419238 0.19709034 0.55807192 1.0 Zr Zr6 1 0.80289590 0.19708742 0.94193434 1.0 Zr Zr7 1 0.80290659 0.60581017 0.94192265 1.0 Zr Zr8 1 0.39419238 0.19709034 0.94192808 1.0 Zr Zr9 1 0.19710410 0.80291258 0.05806566 1.0 Zr Zr10 1 0.19709341 0.39418983 0.05807735 1.0 Zr Zr11 1 0.60580762 0.80290966 0.05807192 1.0 Zr Zr12 1 0.54212834 0.45787121 0.25000000 1.0 Zr Zr13 1 0.54212007 0.08424893 0.25000000 1.0 Zr Zr14 1 0.91574647 0.45788108 0.25000000 1.0 Zr Zr15 1 0.45787166 0.54212879 0.75000000 1.0 Zr Zr16 1 0.45787993 0.91575107 0.75000000 1.0 Zr Zr17 1 0.08425353 0.54211892 0.75000000 1.0 V V18 1 0.00000000 0.00000000 0.50000000 1.0 V V19 1 0.00000000 0.00000000 0.00000000 1.0 Re Re20 1 0.89293039 0.10706193 0.25000000 1.0 Re Re21 1 0.89293098 0.78586944 0.25000000 1.0 Re Re22 1 0.21413003 0.10706713 0.25000000 1.0 Re Re23 1 0.10706961 0.89293807 0.75000000 1.0 Re Re24 1 0.10706902 0.21413056 0.75000000 1.0 Re Re25 1 0.78586997 0.89293287 0.75000000 1.0 Ni Ni26 1 0.33332938 0.66668443 0.25000000 1.0 Ni Ni27 1 0.66667062 0.33331557 0.75000000 1.0