# generated using pymatgen data_Pr2Nd10Ga2I17 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.95373436 _cell_length_b 11.86631821 _cell_length_c 11.71138272 _cell_angle_alpha 93.37210844 _cell_angle_beta 104.64583604 _cell_angle_gamma 115.66571948 _symmetry_Int_Tables_number 1 _chemical_formula_structural Pr2Nd10Ga2I17 _chemical_formula_sum 'Pr2 Nd10 Ga2 I17' _cell_volume 1183.60187404 _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 Pr Pr0 1 0.78680380 0.34814139 0.99076530 1.0 Pr Pr1 1 0.83552996 0.70341459 0.85738330 1.0 Nd Nd2 1 0.06753164 0.52923693 0.33109032 1.0 Nd Nd3 1 0.99026474 0.81182900 0.57362023 1.0 Nd Nd4 1 0.62745014 0.24018178 0.28033716 1.0 Nd Nd5 1 0.00985746 0.18754381 0.42618692 1.0 Nd Nd6 1 0.21237193 0.65261000 0.00815500 1.0 Nd Nd7 1 0.27899992 0.99759967 0.90886812 1.0 Nd Nd8 1 0.37294800 0.75918666 0.72008972 1.0 Nd Nd9 1 0.93266194 0.47018814 0.66993764 1.0 Nd Nd10 1 0.72120882 0.00254902 0.09085353 1.0 Nd Nd11 1 0.16284408 0.29630444 0.14293426 1.0 Ga Ga12 1 0.10700236 0.73529909 0.78855002 1.0 Ga Ga13 1 0.89361952 0.26459056 0.21162570 1.0 I I14 1 0.77715447 0.52830086 0.41600144 1.0 I I15 1 0.61791807 0.41089663 0.73331352 1.0 I I16 1 0.83916559 0.89258864 0.31875329 1.0 I I17 1 0.32009477 0.21044034 0.36855004 1.0 I I18 1 0.16051215 0.10697177 0.68116039 1.0 I I19 1 0.58856810 0.05848496 0.82967784 1.0 I I20 1 0.73487409 0.16344162 0.53198272 1.0 I I21 1 0.53678269 0.68877921 0.96050095 1.0 I I22 1 0.37930673 0.58796158 0.26309531 1.0 I I23 1 0.22304907 0.47082027 0.58453061 1.0 I I24 1 0.06230292 0.35618728 0.88352245 1.0 I I25 1 0.46077954 0.31105181 0.04128468 1.0 I I26 1 0.00127095 0.00141343 0.00059634 1.0 I I27 1 0.26629197 0.83634470 0.46875839 1.0 I I28 1 0.41088338 0.94080785 0.16930991 1.0 I I29 1 0.67977222 0.79103070 0.63003166 1.0 I I30 1 0.94217498 0.64580430 0.11853423 1.0