# generated using pymatgen data_Sm(BeP)3 _symmetry_space_group_name_H-M 'P 1' _cell_length_a 3.68430863 _cell_length_b 10.49596816 _cell_length_c 11.34285568 _cell_angle_alpha 90.00000000 _cell_angle_beta 90.00000000 _cell_angle_gamma 90.00000000 _symmetry_Int_Tables_number 1 _chemical_formula_structural Sm(BeP)3 _chemical_formula_sum 'Sm4 Be12 P12' _cell_volume 438.63260776 _cell_formula_units_Z 4 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 Sm Sm0 1 0.75000000 0.94138226 0.33903543 1.0 Sm Sm1 1 0.25000000 0.44138226 0.16096457 1.0 Sm Sm2 1 0.75000000 0.55861774 0.83903543 1.0 Sm Sm3 1 0.25000000 0.05861774 0.66096457 1.0 Be Be4 1 0.75000000 0.24163651 0.45131190 1.0 Be Be5 1 0.25000000 0.74163651 0.04868810 1.0 Be Be6 1 0.75000000 0.25836349 0.95131190 1.0 Be Be7 1 0.25000000 0.75836349 0.54868810 1.0 Be Be8 1 0.75000000 0.64763642 0.28957772 1.0 Be Be9 1 0.25000000 0.14763642 0.21042228 1.0 Be Be10 1 0.75000000 0.85236358 0.78957772 1.0 Be Be11 1 0.25000000 0.35236358 0.71042228 1.0 Be Be12 1 0.75000000 0.04095790 0.06518098 1.0 Be Be13 1 0.25000000 0.54095790 0.43481902 1.0 Be Be14 1 0.75000000 0.45904210 0.56518098 1.0 Be Be15 1 0.25000000 0.95904210 0.93481902 1.0 P P16 1 0.75000000 0.44281527 0.37141382 1.0 P P17 1 0.25000000 0.94281527 0.12858618 1.0 P P18 1 0.75000000 0.05718473 0.87141382 1.0 P P19 1 0.25000000 0.55718473 0.62858618 1.0 P P20 1 0.75000000 0.23007503 0.14204971 1.0 P P21 1 0.25000000 0.73007503 0.35795029 1.0 P P22 1 0.75000000 0.26992497 0.64204971 1.0 P P23 1 0.25000000 0.76992497 0.85795029 1.0 P P24 1 0.75000000 0.63927773 0.09554606 1.0 P P25 1 0.25000000 0.13927773 0.40445394 1.0 P P26 1 0.75000000 0.86072227 0.59554606 1.0 P P27 1 0.25000000 0.36072227 0.90445394 1.0