# generated using pymatgen data_Mn4Nb4SiP3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.53785022 _cell_length_b 6.27066137 _cell_length_c 7.44670669 _cell_angle_alpha 90.04393001 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Mn4Nb4SiP3 _chemical_formula_sum 'Mn4 Nb4 Si1 P3' _cell_volume 165.20261277 _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 Mn Mn0 1 0.75000000 0.85842908 0.55923711 1.0 Mn Mn1 1 0.25000000 0.13929047 0.44346063 1.0 Mn Mn2 1 0.75000000 0.36447791 0.93971311 1.0 Mn Mn3 1 0.25000000 0.64157532 0.05592293 1.0 Nb Nb4 1 0.25000000 0.53369250 0.67069740 1.0 Nb Nb5 1 0.75000000 0.46726408 0.33250533 1.0 Nb Nb6 1 0.25000000 0.03638242 0.82842036 1.0 Nb Nb7 1 0.75000000 0.95977649 0.17109377 1.0 Si Si8 1 0.25000000 0.26576439 0.13218139 1.0 P P9 1 0.75000000 0.73425879 0.86703599 1.0 P P10 1 0.25000000 0.76675157 0.36639805 1.0 P P11 1 0.75000000 0.23233496 0.63333293 1.0