# generated using pymatgen data_Nd2Mn22C3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 6.45103909 _cell_length_b 7.71663286 _cell_length_c 7.75354351 _cell_angle_alpha 99.12299530 _cell_angle_beta 114.94284062 _cell_angle_gamma 65.65309227 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd2Mn22C3 _chemical_formula_sum 'Nd2 Mn22 C3' _cell_volume 318.79432124 _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 0.37480400 0.74836200 0.24836200 1.0 Nd Nd1 1 0.62519600 0.25163800 0.75163800 1.0 Mn Mn2 1 0.00000000 0.50000000 0.00000000 1.0 Mn Mn3 1 0.00000000 0.50000000 0.50000000 1.0 Mn Mn4 1 0.50000000 0.00000000 0.00000000 1.0 Mn Mn5 1 0.00000000 0.00000000 0.50000000 1.0 Mn Mn6 1 0.13035900 0.24970900 0.74970900 1.0 Mn Mn7 1 0.86964100 0.75029100 0.25029100 1.0 Mn Mn8 1 0.17623800 0.17768500 0.41776100 1.0 Mn Mn9 1 0.43616200 0.91776100 0.67768500 1.0 Mn Mn10 1 0.85332100 0.82283400 0.92070600 1.0 Mn Mn11 1 0.25544900 0.42070600 0.32283400 1.0 Mn Mn12 1 0.18617700 0.57475500 0.82866800 1.0 Mn Mn13 1 0.43226400 0.32866800 0.07475500 1.0 Mn Mn14 1 0.84940700 0.08783800 0.17255200 1.0 Mn Mn15 1 0.26469300 0.67255200 0.58783800 1.0 Mn Mn16 1 0.82376200 0.82231500 0.58223900 1.0 Mn Mn17 1 0.56383800 0.08223900 0.32231500 1.0 Mn Mn18 1 0.14667900 0.17716600 0.07929400 1.0 Mn Mn19 1 0.74455100 0.57929400 0.67716600 1.0 Mn Mn20 1 0.81382300 0.42524500 0.17133200 1.0 Mn Mn21 1 0.56773600 0.67133200 0.92524500 1.0 Mn Mn22 1 0.15059300 0.91216200 0.82744800 1.0 Mn Mn23 1 0.73530700 0.32744800 0.41216200 1.0 C C24 1 0.50000000 0.50000000 0.50000000 1.0 C C25 1 0.00000000 0.00000000 0.00000000 1.0 C C26 1 0.50000000 0.00000000 0.50000000 1.0