# generated using pymatgen data_PaMn12NbP7 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.46214632 _cell_length_b 9.46214674 _cell_length_c 3.58055104 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 119.99999854 _symmetry_Int_Tables_number 1 _chemical_formula_structural PaMn12NbP7 _chemical_formula_sum 'Pa1 Mn12 Nb1 P7' _cell_volume 277.62581400 _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 Pa Pa0 1 0.66666700 0.33333300 0.50000000 1.0 Mn Mn1 1 0.71306539 0.61789611 0.00000000 1.0 Mn Mn2 1 0.38210389 0.09516928 0.00000000 1.0 Mn Mn3 1 0.90483072 0.28693461 0.00000000 1.0 Mn Mn4 1 0.21314781 0.38557544 0.00000000 1.0 Mn Mn5 1 0.61442456 0.82757337 0.00000000 1.0 Mn Mn6 1 0.17242663 0.78685219 0.00000000 1.0 Mn Mn7 1 0.28954859 0.22430538 0.50000000 1.0 Mn Mn8 1 0.77569462 0.06524121 0.50000000 1.0 Mn Mn9 1 0.93475879 0.71045141 0.50000000 1.0 Mn Mn10 1 0.46203955 0.56475105 0.50000000 1.0 Mn Mn11 1 0.43524895 0.89728951 0.50000000 1.0 Mn Mn12 1 0.10271049 0.53796045 0.50000000 1.0 Nb Nb13 1 0.00000000 0.00000000 0.00000000 1.0 P P14 1 0.45413746 0.37853765 0.00000000 1.0 P P15 1 0.62146235 0.07559981 0.00000000 1.0 P P16 1 0.92440019 0.54586254 0.00000000 1.0 P P17 1 0.05033674 0.24107738 0.50000000 1.0 P P18 1 0.75892262 0.80926135 0.50000000 1.0 P P19 1 0.19073865 0.94966326 0.50000000 1.0 P P20 1 0.33333300 0.66666700 0.00000000 1.0