# generated using pymatgen data_Mg2Ga5Cu6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.19888214 _cell_length_b 8.19888302 _cell_length_c 8.19888309 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000056 _cell_angle_gamma 89.99999881 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mg2Ga5Cu6 _chemical_formula_sum 'Mg6 Ga15 Cu18' _cell_volume 551.14265904 _cell_formula_units_Z 3 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 Mg Mg0 1 0.81868181 0.00000002 0.49999998 1.0 Mg Mg1 1 -0.00000000 0.49999997 0.81868185 1.0 Mg Mg2 1 0.49999998 0.81868188 0.00000004 1.0 Mg Mg3 1 0.00000003 0.50000005 0.18131814 1.0 Mg Mg4 1 0.49999998 0.18131817 0.00000002 1.0 Mg Mg5 1 0.18131829 0.00000005 0.49999993 1.0 Ga Ga6 1 0.28195292 0.71804708 0.28195297 1.0 Ga Ga7 1 0.71804706 0.28195293 0.28195294 1.0 Ga Ga8 1 0.28195296 0.28195294 0.71804705 1.0 Ga Ga9 1 0.71804710 0.71804705 0.71804705 1.0 Ga Ga10 1 0.71804699 0.28195292 0.71804702 1.0 Ga Ga11 1 0.28195293 0.71804710 0.71804704 1.0 Ga Ga12 1 0.71804707 0.71804707 0.28195294 1.0 Ga Ga13 1 0.28195289 0.28195294 0.28195302 1.0 Ga Ga14 1 0.66387903 0.49999985 0.00000004 1.0 Ga Ga15 1 0.49999986 0.00000010 0.66387892 1.0 Ga Ga16 1 0.00000006 0.66387906 0.50000002 1.0 Ga Ga17 1 0.50000010 0.00000004 0.33612104 1.0 Ga Ga18 1 0.00000002 0.33612101 0.49999978 1.0 Ga Ga19 1 0.33612100 0.50000012 0.00000011 1.0 Ga Ga20 1 0.00000002 0.00000006 0.00000004 1.0 Cu Cu21 1 0.00000004 0.83638102 0.25739523 1.0 Cu Cu22 1 -0.00000014 0.16361867 0.74260459 1.0 Cu Cu23 1 0.00000004 0.83638094 0.74260555 1.0 Cu Cu24 1 0.16361904 0.74260571 0.00000000 1.0 Cu Cu25 1 0.74260501 -0.00000001 0.83638084 1.0 Cu Cu26 1 0.74260576 0.00000016 0.16361908 1.0 Cu Cu27 1 0.83638085 0.25739453 0.00000009 1.0 Cu Cu28 1 0.25739450 0.00000027 0.83638098 1.0 Cu Cu29 1 0.83638122 0.74260490 0.00000032 1.0 Cu Cu30 1 0.27529682 0.49999986 0.49999980 1.0 Cu Cu31 1 0.49999974 0.27529664 0.49999972 1.0 Cu Cu32 1 0.50000008 0.49999972 0.27529667 1.0 Cu Cu33 1 0.49999982 0.72470340 0.50000003 1.0 Cu Cu34 1 0.49999990 0.49999973 0.72470333 1.0 Cu Cu35 1 0.72470320 0.49999979 0.49999996 1.0 Cu Cu36 1 0.00000004 0.16361905 0.25739436 1.0 Cu Cu37 1 0.25739498 0.00000013 0.16361931 1.0 Cu Cu38 1 0.16361902 0.25739509 0.00000021 1.0