# generated using pymatgen data_Nd2Mn4Ni8P7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.24316965 _cell_length_b 9.21960459 _cell_length_c 3.75321785 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.88684370 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2Mn4Ni8P7 _chemical_formula_sum 'Nd2 Mn4 Ni8 P7' _cell_volume 277.30755071 _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 Nd Nd0 1 0.66565564 0.33157647 0.00000000 1.0 Nd Nd1 1 0.33545746 0.66467132 0.50000000 1.0 Mn Mn2 1 0.12283255 0.84744492 0.50000000 1.0 Mn Mn3 1 0.22420210 0.10955397 0.00000000 1.0 Mn Mn4 1 0.89542986 0.11775840 0.00000000 1.0 Mn Mn5 1 0.87802964 0.77422875 0.00000000 1.0 Ni Ni6 1 0.42892414 0.06440412 0.50000000 1.0 Ni Ni7 1 0.93900189 0.36649463 0.50000000 1.0 Ni Ni8 1 0.63285489 0.57211028 0.50000000 1.0 Ni Ni9 1 0.15171571 0.27674652 0.50000000 1.0 Ni Ni10 1 0.72240577 0.87590957 0.50000000 1.0 Ni Ni11 1 0.38700576 0.43547062 0.00000000 1.0 Ni Ni12 1 0.56849376 0.94974548 0.00000000 1.0 Ni Ni13 1 0.04910320 0.61363970 0.00000000 1.0 P P14 1 0.11056588 0.40267156 0.00000000 1.0 P P15 1 0.59586303 0.70714886 0.00000000 1.0 P P16 1 0.29767646 0.89120601 0.00000000 1.0 P P17 1 0.99768328 0.00169757 0.50000000 1.0 P P18 1 0.40879735 0.30700406 0.50000000 1.0 P P19 1 0.69415214 0.10321333 0.50000000 1.0 P P20 1 0.89415050 0.58730284 0.50000000 1.0