# generated using pymatgen data_Sc2Ga2Si2Mo3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.70811335 _cell_length_b 6.66824591 _cell_length_c 6.90443385 _cell_angle_alpha 70.12415483 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc2Ga2Si2Mo3 _chemical_formula_sum 'Sc4 Ga4 Si4 Mo6' _cell_volume 290.44724376 _cell_formula_units_Z 2 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 Sc Sc0 1 0.33311227 0.55979395 0.80304305 1.0 Sc Sc1 1 0.83311227 0.94020605 0.19695695 1.0 Sc Sc2 1 0.66688773 0.44020605 0.19695695 1.0 Sc Sc3 1 0.16688773 0.05979395 0.80304305 1.0 Ga Ga4 1 0.53698284 0.85428442 0.92478975 1.0 Ga Ga5 1 0.03698284 0.64571558 0.07521025 1.0 Ga Ga6 1 0.46301716 0.14571558 0.07521025 1.0 Ga Ga7 1 0.96301716 0.35428442 0.92478975 1.0 Si Si8 1 0.12916714 0.86848817 0.50940064 1.0 Si Si9 1 0.62916714 0.63151183 0.49059936 1.0 Si Si10 1 0.87083286 0.13151183 0.49059936 1.0 Si Si11 1 0.37083286 0.36848817 0.50940064 1.0 Mo Mo12 1 0.50000000 0.00000000 0.50000000 1.0 Mo Mo13 1 0.00000000 0.50000000 0.50000000 1.0 Mo Mo14 1 0.82399527 0.75149645 0.73295761 1.0 Mo Mo15 1 0.32399527 0.74850355 0.26704239 1.0 Mo Mo16 1 0.17600473 0.24850355 0.26704239 1.0 Mo Mo17 1 0.67600473 0.25149645 0.73295761 1.0