# generated using pymatgen data_ErNbP7Ru12 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.31233964 _cell_length_b 9.31233903 _cell_length_c 3.87981130 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 120.00000469 _symmetry_Int_Tables_number 1 _chemical_formula_structural ErNbP7Ru12 _chemical_formula_sum 'Er1 Nb1 P7 Ru12' _cell_volume 291.37937005 _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 Er Er0 1 0.33333300 0.66666700 0.00000000 1.0 Nb Nb1 1 0.66666700 0.33333300 0.50000000 1.0 P P2 1 0.59772480 0.71908838 0.50000000 1.0 P P3 1 0.00000000 0.00000000 0.00000000 1.0 P P4 1 0.28091162 0.87863641 0.50000000 1.0 P P5 1 0.12136359 0.40227520 0.50000000 1.0 P P6 1 0.88666702 0.57320520 0.00000000 1.0 P P7 1 0.42679480 0.31346281 0.00000000 1.0 P P8 1 0.68653719 0.11333298 0.00000000 1.0 Ru Ru9 1 0.55764218 0.95626842 0.50000000 1.0 Ru Ru10 1 0.39862724 0.44235782 0.50000000 1.0 Ru Ru11 1 0.91436587 0.12343549 0.50000000 1.0 Ru Ru12 1 0.20907062 0.08563413 0.50000000 1.0 Ru Ru13 1 0.87656451 0.79092938 0.50000000 1.0 Ru Ru14 1 0.72549391 0.88846708 0.00000000 1.0 Ru Ru15 1 0.11153292 0.83702683 0.00000000 1.0 Ru Ru16 1 0.16297317 0.27450609 0.00000000 1.0 Ru Ru17 1 0.43042878 0.07852608 0.00000000 1.0 Ru Ru18 1 0.92147392 0.35190370 0.00000000 1.0 Ru Ru19 1 0.64809630 0.56957122 0.00000000 1.0 Ru Ru20 1 0.04373158 0.60137276 0.50000000 1.0