# generated using pymatgen data_SrMg4 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 10.46322058 _cell_length_b 10.46322058 _cell_length_c 27.91652200 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000369 _symmetry_Int_Tables_number 1 _chemical_formula_structural SrMg4 _chemical_formula_sum 'Sr18 Mg72' _cell_volume 2646.80952141 _cell_formula_units_Z 18 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 0.13565900 0.86434100 0.06159700 1.0 Sr Sr1 1 0.86434100 0.13565900 0.93840300 1.0 Sr Sr2 1 0.94035300 0.47017600 0.25000000 1.0 Sr Sr3 1 0.13565900 0.27131800 0.06159700 1.0 Sr Sr4 1 0.47017600 0.52982400 0.75000000 1.0 Sr Sr5 1 0.86434100 0.72868200 0.93840300 1.0 Sr Sr6 1 0.86434100 0.72868200 0.56159700 1.0 Sr Sr7 1 0.52982400 0.47017600 0.25000000 1.0 Sr Sr8 1 0.72868200 0.86434100 0.06159700 1.0 Sr Sr9 1 0.13565900 0.27131800 0.43840300 1.0 Sr Sr10 1 0.27131800 0.13565900 0.93840300 1.0 Sr Sr11 1 0.72868200 0.86434100 0.43840300 1.0 Sr Sr12 1 0.13565900 0.86434100 0.43840300 1.0 Sr Sr13 1 0.52982400 0.05964700 0.25000000 1.0 Sr Sr14 1 0.86434100 0.13565900 0.56159700 1.0 Sr Sr15 1 0.27131800 0.13565900 0.56159700 1.0 Sr Sr16 1 0.47017600 0.94035300 0.75000000 1.0 Sr Sr17 1 0.05964700 0.52982400 0.75000000 1.0 Mg Mg18 1 0.00000000 0.00000000 0.34155100 1.0 Mg Mg19 1 0.83226700 0.66453400 0.34660800 1.0 Mg Mg20 1 0.23387300 0.76612700 0.94540200 1.0 Mg Mg21 1 0.83226700 0.66453400 0.15339200 1.0 Mg Mg22 1 0.64778800 0.82389400 0.18807800 1.0 Mg Mg23 1 0.33333300 0.66666700 0.85158500 1.0 Mg Mg24 1 0.66666700 0.33333300 0.35158500 1.0 Mg Mg25 1 0.17610600 0.82389400 0.18807800 1.0 Mg Mg26 1 0.00000000 0.00000000 0.65844900 1.0 Mg Mg27 1 0.83226700 0.16773300 0.34660800 1.0 Mg Mg28 1 0.76612700 0.23387300 0.44540200 1.0 Mg Mg29 1 0.51151800 0.48848200 0.88140400 1.0 Mg Mg30 1 0.53225500 0.76612700 0.55459800 1.0 Mg Mg31 1 0.82389400 0.17610600 0.68807800 1.0 Mg Mg32 1 0.76612700 0.53225500 0.05459800 1.0 Mg Mg33 1 0.16773300 0.33546600 0.65339200 1.0 Mg Mg34 1 0.16773300 0.33546600 0.84660800 1.0 Mg Mg35 1 0.33546600 0.16773300 0.15339200 1.0 Mg Mg36 1 0.02303700 0.51151800 0.38140400 1.0 Mg Mg37 1 0.17610600 0.35221200 0.31192200 1.0 Mg Mg38 1 0.53225500 0.76612700 0.94540200 1.0 Mg Mg39 1 0.33333300 0.66666700 0.64841500 1.0 Mg Mg40 1 0.33333300 0.66666700 0.04596700 1.0 Mg Mg41 1 0.00000000 0.00000000 0.84155100 1.0 Mg Mg42 1 0.50000000 0.00000000 0.50000000 1.0 Mg Mg43 1 0.90100500 0.80201000 0.25000000 1.0 Mg Mg44 1 0.33546600 0.16773300 0.34660800 1.0 Mg Mg45 1 0.51151800 0.02303700 0.61859600 1.0 Mg Mg46 1 0.76612700 0.53225500 0.44540200 1.0 Mg Mg47 1 0.51151800 0.48848200 0.61859600 1.0 Mg Mg48 1 0.23387300 0.76612700 0.55459800 1.0 Mg Mg49 1 0.66666700 0.33333300 0.14841500 1.0 Mg Mg50 1 0.76612700 0.23387300 0.05459800 1.0 Mg Mg51 1 0.23387300 0.46774500 0.94540200 1.0 Mg Mg52 1 0.35221200 0.17610600 0.68807800 1.0 Mg Mg53 1 0.00000000 0.00000000 0.15844900 1.0 Mg Mg54 1 0.00000000 0.50000000 0.50000000 1.0 Mg Mg55 1 0.80201000 0.90100500 0.75000000 1.0 Mg Mg56 1 0.66666700 0.33333300 0.95403300 1.0 Mg Mg57 1 0.97696300 0.48848200 0.88140400 1.0 Mg Mg58 1 0.46774500 0.23387300 0.05459800 1.0 Mg Mg59 1 0.97696300 0.48848200 0.61859600 1.0 Mg Mg60 1 0.48848200 0.97696300 0.38140400 1.0 Mg Mg61 1 0.16773300 0.83226700 0.84660800 1.0 Mg Mg62 1 0.48848200 0.51151800 0.11859600 1.0 Mg Mg63 1 0.82389400 0.17610600 0.81192200 1.0 Mg Mg64 1 0.82389400 0.64778800 0.68807800 1.0 Mg Mg65 1 0.17610600 0.35221200 0.18807800 1.0 Mg Mg66 1 0.50000000 0.50000000 0.50000000 1.0 Mg Mg67 1 0.66453400 0.83226700 0.84660800 1.0 Mg Mg68 1 0.48848200 0.97696300 0.11859600 1.0 Mg Mg69 1 0.00000000 0.50000000 0.00000000 1.0 Mg Mg70 1 0.50000000 0.50000000 0.00000000 1.0 Mg Mg71 1 0.09899500 0.90100500 0.75000000 1.0 Mg Mg72 1 0.33333300 0.66666700 0.45403300 1.0 Mg Mg73 1 0.66453400 0.83226700 0.65339200 1.0 Mg Mg74 1 0.19799000 0.09899500 0.25000000 1.0 Mg Mg75 1 0.90100500 0.09899500 0.25000000 1.0 Mg Mg76 1 0.02303700 0.51151800 0.11859600 1.0 Mg Mg77 1 0.82389400 0.64778800 0.81192200 1.0 Mg Mg78 1 0.16773300 0.83226700 0.65339200 1.0 Mg Mg79 1 0.83226700 0.16773300 0.15339200 1.0 Mg Mg80 1 0.64778800 0.82389400 0.31192200 1.0 Mg Mg81 1 0.50000000 0.00000000 0.00000000 1.0 Mg Mg82 1 0.09899500 0.19799000 0.75000000 1.0 Mg Mg83 1 0.51151800 0.02303700 0.88140400 1.0 Mg Mg84 1 0.17610600 0.82389400 0.31192200 1.0 Mg Mg85 1 0.66666700 0.33333300 0.54596700 1.0 Mg Mg86 1 0.46774500 0.23387300 0.44540200 1.0 Mg Mg87 1 0.48848200 0.51151800 0.38140400 1.0 Mg Mg88 1 0.35221200 0.17610600 0.81192200 1.0 Mg Mg89 1 0.23387300 0.46774500 0.55459800 1.0