# generated using pymatgen data_Mn2SiMo3C _symmetry_space_group_name_H-M 'P 1' _cell_length_a 7.94147409 _cell_length_b 7.94147384 _cell_length_c 7.94147299 _cell_angle_alpha 59.99999928 _cell_angle_beta 60.00000031 _cell_angle_gamma 60.00000164 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn2SiMo3C _chemical_formula_sum 'Mn8 Si4 Mo12 C4' _cell_volume 354.15086096 _cell_formula_units_Z 4 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 Mn Mn0 1 0.24667640 0.91777453 0.91777453 1.0 Mn Mn1 1 0.91777453 0.24667640 0.91777453 1.0 Mn Mn2 1 0.33222547 0.33222547 0.33222547 1.0 Mn Mn3 1 0.33222547 0.00332360 0.33222547 1.0 Mn Mn4 1 0.33222547 0.33222547 0.00332360 1.0 Mn Mn5 1 0.00332360 0.33222547 0.33222547 1.0 Mn Mn6 1 0.91777453 0.91777453 0.91777453 1.0 Mn Mn7 1 0.91777453 0.91777453 0.24667640 1.0 Si Si8 1 0.12500000 0.12500000 0.62500000 1.0 Si Si9 1 0.12500000 0.62500000 0.12500000 1.0 Si Si10 1 0.62500000 0.12500000 0.12500000 1.0 Si Si11 1 0.12500000 0.12500000 0.12500000 1.0 Mo Mo12 1 0.55814131 0.55814131 0.94185869 1.0 Mo Mo13 1 0.94185869 0.94185869 0.55814131 1.0 Mo Mo14 1 0.69185869 0.69185869 0.30814131 1.0 Mo Mo15 1 0.30814131 0.69185869 0.69185869 1.0 Mo Mo16 1 0.69185869 0.30814131 0.30814131 1.0 Mo Mo17 1 0.30814131 0.30814131 0.69185869 1.0 Mo Mo18 1 0.55814131 0.94185869 0.55814131 1.0 Mo Mo19 1 0.30814131 0.69185869 0.30814131 1.0 Mo Mo20 1 0.94185869 0.55814131 0.94185869 1.0 Mo Mo21 1 0.94185869 0.55814131 0.55814131 1.0 Mo Mo22 1 0.69185869 0.30814131 0.69185869 1.0 Mo Mo23 1 0.55814131 0.94185869 0.94185869 1.0 C C24 1 0.62500000 0.62500000 0.12500000 1.0 C C25 1 0.12500000 0.62500000 0.62500000 1.0 C C26 1 0.62500000 0.12500000 0.62500000 1.0 C C27 1 0.62500000 0.62500000 0.62500000 1.0