# generated using pymatgen data_La2MgNi2 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.65299600 _cell_length_b 10.98043000 _cell_length_c 10.99046198 _cell_angle_alpha 88.23793285 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural La2MgNi2 _chemical_formula_sum 'La16 Mg8 Ni16' _cell_volume 923.12682654 _cell_formula_units_Z 8 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 La La0 1 0.82620300 0.83392100 0.17377200 1.0 La La1 1 0.32620300 0.16607900 0.32622800 1.0 La La2 1 0.17379700 0.16607900 0.82622800 1.0 La La3 1 0.67379700 0.83392100 0.67377200 1.0 La La4 1 0.82035200 0.58584300 0.91848600 1.0 La La5 1 0.32035200 0.41415700 0.58151400 1.0 La La6 1 0.17964800 0.41415700 0.08151400 1.0 La La7 1 0.67964800 0.58584300 0.41848600 1.0 La La8 1 0.32625400 0.91122100 0.09446300 1.0 La La9 1 0.82625400 0.08877900 0.40553700 1.0 La La10 1 0.67374600 0.08877900 0.90553700 1.0 La La11 1 0.17374600 0.91122100 0.59446300 1.0 La La12 1 0.17633900 0.66658600 0.34259500 1.0 La La13 1 0.67633900 0.33341400 0.15740500 1.0 La La14 1 0.82366100 0.33341400 0.65740500 1.0 La La15 1 0.32366100 0.66658600 0.84259500 1.0 Mg Mg16 1 0.99716300 0.87356500 0.88740300 1.0 Mg Mg17 1 0.49716300 0.12643500 0.61259700 1.0 Mg Mg18 1 0.00283700 0.12643500 0.11259700 1.0 Mg Mg19 1 0.50283700 0.87356500 0.38740300 1.0 Mg Mg20 1 0.99914200 0.62088100 0.63285000 1.0 Mg Mg21 1 0.49914200 0.37911900 0.86715000 1.0 Mg Mg22 1 0.00085800 0.37911900 0.36715000 1.0 Mg Mg23 1 0.50085800 0.62088100 0.13285000 1.0 Ni Ni24 1 0.63075000 0.82120900 0.94440100 1.0 Ni Ni25 1 0.13075000 0.17879100 0.55559900 1.0 Ni Ni26 1 0.36925000 0.17879100 0.05559900 1.0 Ni Ni27 1 0.86925000 0.82120900 0.44440100 1.0 Ni Ni28 1 0.87176400 0.32095400 0.92597000 1.0 Ni Ni29 1 0.37176400 0.67904600 0.57403000 1.0 Ni Ni30 1 0.12823600 0.67904600 0.07403000 1.0 Ni Ni31 1 0.62823600 0.32095400 0.42597000 1.0 Ni Ni32 1 0.86335900 0.06781200 0.66748200 1.0 Ni Ni33 1 0.36335900 0.93218800 0.83251800 1.0 Ni Ni34 1 0.13664100 0.93218800 0.33251800 1.0 Ni Ni35 1 0.63664100 0.06781200 0.16748200 1.0 Ni Ni36 1 0.62376600 0.56230300 0.68589000 1.0 Ni Ni37 1 0.12376600 0.43769700 0.81411000 1.0 Ni Ni38 1 0.37623400 0.43769700 0.31411000 1.0 Ni Ni39 1 0.87623400 0.56230300 0.18589000 1.0