# generated using pymatgen data_Sc5Mo2C7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.97244503 _cell_length_b 7.97244535 _cell_length_c 3.22830789 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.73189833 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sc5Mo2C7 _chemical_formula_sum 'Sc5 Mo2 C7' _cell_volume 176.37548558 _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 Sc Sc0 1 0.08187653 0.33728378 0.50000000 1.0 Sc Sc1 1 0.33728378 0.08187653 0.50000000 1.0 Sc Sc2 1 0.50000000 0.50000000 0.00000000 1.0 Sc Sc3 1 0.91812347 0.66271622 0.50000000 1.0 Sc Sc4 1 0.66271622 0.91812347 0.50000000 1.0 Mo Mo5 1 0.71283252 0.28716748 0.00000000 1.0 Mo Mo6 1 0.28716748 0.71283252 0.00000000 1.0 C C7 1 0.00000000 0.00000000 0.00000000 1.0 C C8 1 0.00000000 0.50000000 0.00000000 1.0 C C9 1 0.50000000 0.00000000 0.00000000 1.0 C C10 1 0.17041026 0.17041026 0.00000000 1.0 C C11 1 0.82958974 0.82958974 0.00000000 1.0 C C12 1 0.61732367 0.38267633 0.50000000 1.0 C C13 1 0.38267633 0.61732367 0.50000000 1.0