# generated using pymatgen data_Sr(Ni5P3)2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.45135200 _cell_length_b 8.70320000 _cell_length_c 15.96422300 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sr(Ni5P3)2 _chemical_formula_sum 'Sr4 Ni40 P24' _cell_volume 896.34972185 _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 Sr Sr0 1 0.25000000 0.48374300 0.75073700 1.0 Sr Sr1 1 0.25000000 0.01625700 0.25073700 1.0 Sr Sr2 1 0.75000000 0.51625700 0.24926300 1.0 Sr Sr3 1 0.75000000 0.98374300 0.74926300 1.0 Ni Ni4 1 0.25000000 0.39374900 0.29426600 1.0 Ni Ni5 1 0.94775100 0.04672200 0.42440300 1.0 Ni Ni6 1 0.25000000 0.86684500 0.70732000 1.0 Ni Ni7 1 0.75000000 0.19252000 0.96051300 1.0 Ni Ni8 1 0.05224900 0.54672200 0.07559700 1.0 Ni Ni9 1 0.99888400 0.73400700 0.91601100 1.0 Ni Ni10 1 0.45016600 0.48519100 0.42339900 1.0 Ni Ni11 1 0.54983400 0.98519100 0.07660100 1.0 Ni Ni12 1 0.75000000 0.36684500 0.79268000 1.0 Ni Ni13 1 0.95016600 0.98519100 0.07660100 1.0 Ni Ni14 1 0.25000000 0.27798500 0.94837300 1.0 Ni Ni15 1 0.25000000 0.63315500 0.20732000 1.0 Ni Ni16 1 0.75000000 0.13315500 0.29268000 1.0 Ni Ni17 1 0.75000000 0.30748000 0.46051300 1.0 Ni Ni18 1 0.25000000 0.22201500 0.44837300 1.0 Ni Ni19 1 0.00111600 0.26599300 0.08398900 1.0 Ni Ni20 1 0.94775100 0.45327800 0.92440300 1.0 Ni Ni21 1 0.99888400 0.76599300 0.41601100 1.0 Ni Ni22 1 0.25000000 0.69252000 0.53948700 1.0 Ni Ni23 1 0.00111600 0.23400700 0.58398900 1.0 Ni Ni24 1 0.55224900 0.04672200 0.42440300 1.0 Ni Ni25 1 0.25000000 0.10625100 0.79426600 1.0 Ni Ni26 1 0.05224900 0.95327800 0.57559700 1.0 Ni Ni27 1 0.50111600 0.76599300 0.41601100 1.0 Ni Ni28 1 0.44775100 0.95327800 0.57559700 1.0 Ni Ni29 1 0.50111600 0.73400700 0.91601100 1.0 Ni Ni30 1 0.44775100 0.54672200 0.07559700 1.0 Ni Ni31 1 0.75000000 0.89374900 0.20573400 1.0 Ni Ni32 1 0.49888400 0.26599300 0.08398900 1.0 Ni Ni33 1 0.55224900 0.45327800 0.92440300 1.0 Ni Ni34 1 0.75000000 0.72201500 0.05162700 1.0 Ni Ni35 1 0.04983400 0.48519100 0.42339900 1.0 Ni Ni36 1 0.75000000 0.77798500 0.55162700 1.0 Ni Ni37 1 0.45016600 0.01480900 0.92339900 1.0 Ni Ni38 1 0.54983400 0.51480900 0.57660100 1.0 Ni Ni39 1 0.95016600 0.51480900 0.57660100 1.0 Ni Ni40 1 0.04983400 0.01480900 0.92339900 1.0 Ni Ni41 1 0.75000000 0.60625100 0.70573400 1.0 Ni Ni42 1 0.49888400 0.23400700 0.58398900 1.0 Ni Ni43 1 0.25000000 0.80748000 0.03948700 1.0 P P44 1 0.25000000 0.94110200 0.45732300 1.0 P P45 1 0.25000000 0.11415700 0.65853500 1.0 P P46 1 0.75000000 0.05889800 0.54267700 1.0 P P47 1 0.75000000 0.58077700 0.45894500 1.0 P P48 1 0.50758900 0.23387300 0.85477800 1.0 P P49 1 0.25000000 0.64517900 0.34361700 1.0 P P50 1 0.99241100 0.23387300 0.85477800 1.0 P P51 1 0.00758900 0.73387300 0.64522200 1.0 P P52 1 0.49241100 0.76612700 0.14522200 1.0 P P53 1 0.25000000 0.55889800 0.95732300 1.0 P P54 1 0.75000000 0.91922300 0.95894500 1.0 P P55 1 0.75000000 0.35482100 0.65638300 1.0 P P56 1 0.25000000 0.41922300 0.54105500 1.0 P P57 1 0.49241100 0.73387300 0.64522200 1.0 P P58 1 0.75000000 0.14517900 0.15638300 1.0 P P59 1 0.25000000 0.38584300 0.15853500 1.0 P P60 1 0.99241100 0.26612700 0.35477800 1.0 P P61 1 0.75000000 0.88584300 0.34146500 1.0 P P62 1 0.50758900 0.26612700 0.35477800 1.0 P P63 1 0.75000000 0.61415700 0.84146500 1.0 P P64 1 0.25000000 0.08077700 0.04105500 1.0 P P65 1 0.00758900 0.76612700 0.14522200 1.0 P P66 1 0.75000000 0.44110200 0.04267700 1.0 P P67 1 0.25000000 0.85482100 0.84361700 1.0