# generated using pymatgen data_Nd3MnMoC6 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 8.35913547 _cell_length_b 8.35914859 _cell_length_c 5.25124122 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99980684 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd3MnMoC6 _chemical_formula_sum 'Nd6 Mn2 Mo2 C12' _cell_volume 317.77289767 _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 Nd Nd0 1 0.61714449 0.68206410 0.75000000 1.0 Nd Nd1 1 0.93507990 0.61714416 0.25000000 1.0 Nd Nd2 1 0.68206447 0.06492087 0.25000000 1.0 Nd Nd3 1 0.31793553 0.93507913 0.75000000 1.0 Nd Nd4 1 0.06492010 0.38285584 0.75000000 1.0 Nd Nd5 1 0.38285551 0.31793590 0.25000000 1.0 Mn Mn6 1 0.66666489 0.33333289 0.75000000 1.0 Mn Mn7 1 0.33333511 0.66666711 0.25000000 1.0 Mo Mo8 1 0.00000000 0.00000000 0.50000000 1.0 Mo Mo9 1 0.00000000 0.00000000 0.00000000 1.0 C C10 1 0.95702517 0.76029653 0.75000000 1.0 C C11 1 0.19673383 0.95701935 0.25000000 1.0 C C12 1 0.76029075 0.80326812 0.25000000 1.0 C C13 1 0.23970925 0.19673188 0.75000000 1.0 C C14 1 0.80326617 0.04298065 0.75000000 1.0 C C15 1 0.04297483 0.23970347 0.25000000 1.0 C C16 1 0.85917465 0.57187898 0.75000000 1.0 C C17 1 0.28728901 0.85918274 0.25000000 1.0 C C18 1 0.57188829 0.71270903 0.25000000 1.0 C C19 1 0.42811171 0.28729097 0.75000000 1.0 C C20 1 0.14082535 0.42812102 0.25000000 1.0 C C21 1 0.71271099 0.14081726 0.75000000 1.0