# generated using pymatgen data_Zr6Co3Ni17P13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.39070032 _cell_length_b 12.39070131 _cell_length_c 3.60974904 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999476 _symmetry_Int_Tables_number 1 _chemical_formula_structural Zr6Co3Ni17P13 _chemical_formula_sum 'Zr6 Co3 Ni17 P13' _cell_volume 479.95376787 _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 Zr Zr0 1 0.80779267 0.94810799 0.00000000 1.0 Zr Zr1 1 0.05189201 0.85968568 0.00000000 1.0 Zr Zr2 1 0.14031432 0.19220733 0.00000000 1.0 Zr Zr3 1 0.52530431 0.14280768 0.50000000 1.0 Zr Zr4 1 0.85719232 0.38249663 0.50000000 1.0 Zr Zr5 1 0.61750337 0.47469569 0.50000000 1.0 Co Co6 1 0.53009368 0.76885497 0.00000000 1.0 Co Co7 1 0.23114503 0.76123871 0.00000000 1.0 Co Co8 1 0.23876129 0.46990632 0.00000000 1.0 Ni Ni9 1 0.00000000 0.00000000 0.50000000 1.0 Ni Ni10 1 0.41194356 0.82813150 0.50000000 1.0 Ni Ni11 1 0.17186850 0.58381106 0.50000000 1.0 Ni Ni12 1 0.41618894 0.58805644 0.50000000 1.0 Ni Ni13 1 0.66666700 0.33333300 0.00000000 1.0 Ni Ni14 1 0.77135317 0.68594717 0.00000000 1.0 Ni Ni15 1 0.31405283 0.08540600 0.00000000 1.0 Ni Ni16 1 0.91459400 0.22864683 0.00000000 1.0 Ni Ni17 1 0.65770561 0.73812586 0.50000000 1.0 Ni Ni18 1 0.26187414 0.91958075 0.50000000 1.0 Ni Ni19 1 0.08041925 0.34229439 0.50000000 1.0 Ni Ni20 1 0.35265762 0.25578849 0.50000000 1.0 Ni Ni21 1 0.74421151 0.09686913 0.50000000 1.0 Ni Ni22 1 0.90313087 0.64734238 0.50000000 1.0 Ni Ni23 1 0.57579721 0.99065243 0.00000000 1.0 Ni Ni24 1 0.00934757 0.58514478 0.00000000 1.0 Ni Ni25 1 0.41485522 0.42420279 0.00000000 1.0 P P26 1 0.86162109 0.80611925 0.50000000 1.0 P P27 1 0.19388075 0.05550184 0.50000000 1.0 P P28 1 0.94449816 0.13837891 0.50000000 1.0 P P29 1 0.61448276 0.89329616 0.50000000 1.0 P P30 1 0.10670384 0.72118560 0.50000000 1.0 P P31 1 0.27881440 0.38551724 0.50000000 1.0 P P32 1 0.47258530 0.28123432 0.00000000 1.0 P P33 1 0.71876568 0.19135199 0.00000000 1.0 P P34 1 0.80864801 0.52741470 0.00000000 1.0 P P35 1 0.38431953 0.95163950 0.00000000 1.0 P P36 1 0.04836050 0.43268103 0.00000000 1.0 P P37 1 0.56731897 0.61568047 0.00000000 1.0 P P38 1 0.33333300 0.66666700 0.00000000 1.0