# CIF generated by HEAS from Alexandria entry agm005237248 data_agm005237248 _cell_length_a 6.26771 _cell_length_b 7.98904 _cell_length_c 9.29854 _cell_angle_alpha 67.25529 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 429.39833 _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 0.75000 0.67860 0.41054 1.00000 Ba2 Ba 0.25000 0.32140 0.58946 1.00000 Ba3 Ba 0.75000 0.26167 0.24757 1.00000 Ba4 Ba 0.25000 0.73833 0.75243 1.00000 V1 V 0.25000 0.95315 0.33397 1.00000 V2 V 0.75000 0.04685 0.66603 1.00000 V3 V 0.75000 0.43561 0.82869 1.00000 V4 V 0.25000 0.56439 0.17131 1.00000 Fe1 Fe 0.50000 0.00000 0.00000 1.00000 Fe2 Fe 0.00000 0.00000 0.00000 1.00000 H1 H 0.75000 0.72872 0.02180 1.00000 H2 H 0.25000 0.27128 0.97820 1.00000 O1 O 0.48714 0.99571 0.21834 1.00000 O2 O 0.98714 0.00429 0.78166 1.00000 O3 O 0.51286 0.00429 0.78166 1.00000 O4 O 0.01286 0.99571 0.21834 1.00000 O5 O 0.53055 0.49935 0.70842 1.00000 O6 O 0.03055 0.50065 0.29158 1.00000 O7 O 0.46945 0.50065 0.29158 1.00000 O8 O 0.96945 0.49935 0.70842 1.00000 O9 O 0.75000 0.19002 0.95144 1.00000 O10 O 0.25000 0.80998 0.04856 1.00000 O11 O 0.25000 0.73011 0.45772 1.00000 O12 O 0.75000 0.26989 0.54228 1.00000 O13 O 0.75000 0.82336 0.06718 1.00000 O14 O 0.25000 0.17664 0.93282 1.00000 O15 O 0.25000 0.07780 0.44685 1.00000 O16 O 0.75000 0.92220 0.55315 1.00000 O17 O 0.75000 0.54923 0.95192 1.00000 O18 O 0.25000 0.45077 0.04808 1.00000