# CIF generated by HEAS from Alexandria entry agm003246777 data_agm003246777 _cell_length_a 8.42016 _cell_length_b 15.07008 _cell_length_c 17.25836 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 2189.95715 _symmetry_space_group_name_H-M 'P 1' _symmetry_Int_Tables_number 1 loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy Ba1 Ba 0.25000 0.24160 0.43665 1.00000 Ba2 Ba 0.25000 0.27020 0.71769 1.00000 Ba3 Ba 0.75000 0.22980 0.21769 1.00000 Ba4 Ba 0.75000 0.25840 0.93665 1.00000 Ba5 Ba 0.25000 0.74160 0.06335 1.00000 Ba6 Ba 0.25000 0.77020 0.78231 1.00000 Ba7 Ba 0.75000 0.72980 0.28231 1.00000 Ba8 Ba 0.75000 0.75840 0.56335 1.00000 Y1 Y 0.25000 0.93337 0.30767 1.00000 Y2 Y 0.75000 0.56663 0.80767 1.00000 Y3 Y 0.25000 0.43337 0.19233 1.00000 Y4 Y 0.75000 0.06663 0.69233 1.00000 I1 I 0.75000 0.09138 0.06617 1.00000 I2 I 0.01339 0.08799 0.33129 1.00000 I3 I 0.48661 0.08799 0.33129 1.00000 I4 I 0.98730 0.12179 0.81879 1.00000 I5 I 0.51270 0.12179 0.81879 1.00000 I6 I 0.51850 0.16760 0.58653 1.00000 I7 I 0.98150 0.16760 0.58653 1.00000 I8 I 0.01850 0.33240 0.08653 1.00000 I9 I 0.48150 0.33240 0.08653 1.00000 I10 I 0.01270 0.37821 0.31879 1.00000 I11 I 0.48730 0.37821 0.31879 1.00000 I12 I 0.98661 0.41201 0.83129 1.00000 I13 I 0.51339 0.41201 0.83129 1.00000 I14 I 0.25000 0.40862 0.56617 1.00000 I15 I 0.75000 0.59138 0.43383 1.00000 I16 I 0.01339 0.58799 0.16871 1.00000 I17 I 0.48661 0.58799 0.16871 1.00000 I18 I 0.98730 0.62179 0.68121 1.00000 I19 I 0.51270 0.62179 0.68121 1.00000 I20 I 0.98150 0.66760 0.91347 1.00000 I21 I 0.51850 0.66760 0.91347 1.00000 I22 I 0.48150 0.83240 0.41347 1.00000 I23 I 0.01850 0.83240 0.41347 1.00000 I24 I 0.48730 0.87821 0.18121 1.00000 I25 I 0.01270 0.87821 0.18121 1.00000 I26 I 0.51339 0.91201 0.66871 1.00000 I27 I 0.98661 0.91201 0.66871 1.00000 I28 I 0.25000 0.90862 0.93383 1.00000