# generated using pymatgen data_Nd4Sm6B2Br15 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 9.26833839 _cell_length_b 10.07365916 _cell_length_c 10.85325269 _cell_angle_alpha 91.21963881 _cell_angle_beta 114.28630884 _cell_angle_gamma 111.05914995 _symmetry_Int_Tables_number 1 _chemical_formula_structural Nd4Sm6B2Br15 _chemical_formula_sum 'Nd4 Sm6 B2 Br15' _cell_volume 844.75838598 _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 0.80484300 0.41317530 0.27975817 1.0 Nd Nd1 1 0.19515700 0.58682470 0.72024183 1.0 Nd Nd2 1 0.67528779 0.74524399 0.81679014 1.0 Nd Nd3 1 0.32471221 0.25475601 0.18320986 1.0 Sm Sm4 1 0.52530909 0.70649397 0.09624600 1.0 Sm Sm5 1 0.47469091 0.29350603 0.90375400 1.0 Sm Sm6 1 0.58611041 0.03819060 0.32469257 1.0 Sm Sm7 1 0.41388959 0.96180940 0.67530743 1.0 Sm Sm8 1 0.72407572 0.07517137 0.04782061 1.0 Sm Sm9 1 0.27592428 0.92482863 0.95217939 1.0 B B10 1 0.46592051 0.81763483 0.87484041 1.0 B B11 1 0.53407949 0.18236517 0.12515959 1.0 Br Br12 1 0.00000000 0.00000000 0.00000000 1.0 Br Br13 1 0.63633168 0.88627296 0.57969790 1.0 Br Br14 1 0.36366832 0.11372704 0.42030210 1.0 Br Br15 1 0.88254984 0.29350792 0.53079591 1.0 Br Br16 1 0.11745016 0.70649208 0.46920409 1.0 Br Br17 1 0.28744292 0.76063872 0.17989762 1.0 Br Br18 1 0.71255708 0.23936128 0.82010238 1.0 Br Br19 1 0.05622429 0.34358557 0.22622252 1.0 Br Br20 1 0.16229986 0.05653738 0.70293623 1.0 Br Br21 1 0.83770014 0.94346262 0.29706377 1.0 Br Br22 1 0.23468579 0.41028488 0.94531395 1.0 Br Br23 1 0.76531421 0.58971512 0.05468605 1.0 Br Br24 1 0.40629784 0.45626561 0.65657974 1.0 Br Br25 1 0.59370216 0.54373439 0.34342026 1.0 Br Br26 1 0.94377571 0.65641443 0.77377748 1.0