# generated using pymatgen data_Sm2Be25Ni _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.27530380 _cell_length_b 7.28964113 _cell_length_c 7.27673021 _cell_angle_alpha 60.19604420 _cell_angle_beta 60.12585409 _cell_angle_gamma 59.94805119 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm2Be25Ni _chemical_formula_sum 'Sm2 Be25 Ni1' _cell_volume 273.43799888 _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 0.24963975 0.25135789 0.24792984 1.0 Sm Sm1 1 0.74891133 0.75206635 0.74866139 1.0 Be Be2 1 0.00129413 0.00061796 0.99940618 1.0 Be Be3 1 0.49981386 0.50121250 0.49878025 1.0 Be Be4 1 0.70583004 0.93826454 0.06174864 1.0 Be Be5 1 0.06523043 0.28864846 0.71140222 1.0 Be Be6 1 0.93585122 0.70986819 0.29012978 1.0 Be Be7 1 0.93754493 0.28868259 0.06334310 1.0 Be Be8 1 0.21170886 0.43602722 0.78901180 1.0 Be Be9 1 0.06242924 0.71122596 0.93706414 1.0 Be Be10 1 0.78877300 0.56300584 0.21148204 1.0 Be Be11 1 0.71074741 0.06290839 0.28876890 1.0 Be Be12 1 0.43675320 0.21096785 0.56400446 1.0 Be Be13 1 0.28949508 0.93669594 0.71132641 1.0 Be Be14 1 0.56323447 0.78853380 0.43700950 1.0 Be Be15 1 0.06316933 0.93686922 0.28919080 1.0 Be Be16 1 0.56393015 0.21240017 0.78763788 1.0 Be Be17 1 0.93727818 0.06329102 0.70925331 1.0 Be Be18 1 0.43508006 0.78896696 0.21097436 1.0 Be Be19 1 0.70984751 0.29076274 0.93668422 1.0 Be Be20 1 0.21047538 0.56380940 0.43617199 1.0 Be Be21 1 0.28923221 0.71079429 0.06314304 1.0 Be Be22 1 0.78879040 0.43579011 0.56422472 1.0 Be Be23 1 0.78838652 0.21170966 0.43688430 1.0 Be Be24 1 0.21126919 0.78682546 0.56573591 1.0 Be Be25 1 0.56391675 0.43409388 0.21323901 1.0 Be Be26 1 0.43698036 0.56312322 0.78828467 1.0 Ni Ni27 1 0.29438800 0.06148137 0.93850616 1.0