# generated using pymatgen data_Sm6Ni20P13 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 12.78060782 _cell_length_b 12.78060782 _cell_length_c 3.81561500 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999909 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm6Ni20P13 _chemical_formula_sum 'Sm6 Ni20 P13' _cell_volume 539.75689685 _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 Sm Sm0 1 0.71821600 0.53107400 0.00000000 1.0 Sm Sm1 1 0.81285900 0.28178400 0.00000000 1.0 Sm Sm2 1 0.46892600 0.18714100 0.00000000 1.0 Sm Sm3 1 0.53164500 0.81298300 0.50000000 1.0 Sm Sm4 1 0.28133800 0.46835500 0.50000000 1.0 Sm Sm5 1 0.18701700 0.71866200 0.50000000 1.0 Ni Ni6 1 0.89616600 0.80622900 0.00000000 1.0 Ni Ni7 1 0.91006300 0.10383400 0.00000000 1.0 Ni Ni8 1 0.19377100 0.08993700 0.00000000 1.0 Ni Ni9 1 0.66666700 0.33333300 0.50000000 1.0 Ni Ni10 1 0.84808000 0.92856700 0.50000000 1.0 Ni Ni11 1 0.08048600 0.15192000 0.50000000 1.0 Ni Ni12 1 0.07143300 0.91951400 0.50000000 1.0 Ni Ni13 1 0.33333300 0.66666700 0.00000000 1.0 Ni Ni14 1 0.97811000 0.56277200 0.00000000 1.0 Ni Ni15 1 0.58466200 0.02189000 0.00000000 1.0 Ni Ni16 1 0.43722800 0.41533800 0.00000000 1.0 Ni Ni17 1 0.92978200 0.68532600 0.50000000 1.0 Ni Ni18 1 0.75554400 0.07021800 0.50000000 1.0 Ni Ni19 1 0.31467400 0.24445600 0.50000000 1.0 Ni Ni20 1 0.41112700 0.97692200 0.50000000 1.0 Ni Ni21 1 0.56579500 0.58887300 0.50000000 1.0 Ni Ni22 1 0.02307800 0.43420500 0.50000000 1.0 Ni Ni23 1 0.68210700 0.75913000 0.00000000 1.0 Ni Ni24 1 0.07702300 0.31789300 0.00000000 1.0 Ni Ni25 1 0.24087000 0.92297700 0.00000000 1.0 P P26 1 0.86551800 0.47860100 0.50000000 1.0 P P27 1 0.61308200 0.13448200 0.50000000 1.0 P P28 1 0.52139900 0.38691800 0.50000000 1.0 P P29 1 0.76891800 0.72441000 0.50000000 1.0 P P30 1 0.95549200 0.23108200 0.50000000 1.0 P P31 1 0.27559000 0.04450800 0.50000000 1.0 P P32 1 0.38575700 0.86473700 0.00000000 1.0 P P33 1 0.47898100 0.61424300 0.00000000 1.0 P P34 1 0.13526300 0.52101900 0.00000000 1.0 P P35 1 0.71957100 0.95356100 0.00000000 1.0 P P36 1 0.23399000 0.28042900 0.00000000 1.0 P P37 1 0.04643900 0.76601000 0.00000000 1.0 P P38 1 0.00000000 0.00000000 0.00000000 1.0