# CIF generated by HEAS from Alexandria entry agm006319087 data_agm006319087 _cell_length_a 7.49989 _cell_length_b 10.56291 _cell_length_c 14.66098 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 1161.45298 _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 Fe1 Fe 0.34472 0.25000 0.37560 1.00000 Fe2 Fe 0.84472 0.75000 0.12440 1.00000 Fe3 Fe 0.15528 0.25000 0.87560 1.00000 Fe4 Fe 0.65528 0.75000 0.62440 1.00000 H1 H 0.45770 0.82583 0.47342 1.00000 H2 H 0.45770 0.67417 0.47342 1.00000 H3 H 0.88046 0.92329 0.39294 1.00000 H4 H 0.88046 0.57671 0.39294 1.00000 H5 H 0.90734 0.41712 0.38887 1.00000 H6 H 0.90734 0.08288 0.38887 1.00000 H7 H 0.70560 0.48222 0.36631 1.00000 H8 H 0.70560 0.01778 0.36631 1.00000 H9 H 0.87312 0.49908 0.29138 1.00000 H10 H 0.87312 0.00092 0.29138 1.00000 H11 H 0.37312 0.99908 0.20862 1.00000 H12 H 0.37312 0.50092 0.20862 1.00000 H13 H 0.20560 0.51778 0.13369 1.00000 H14 H 0.20560 0.98222 0.13369 1.00000 H15 H 0.40734 0.91712 0.11113 1.00000 H16 H 0.40734 0.58288 0.11113 1.00000 H17 H 0.38046 0.42329 0.10706 1.00000 H18 H 0.38046 0.07671 0.10706 1.00000 H19 H 0.95770 0.32583 0.02658 1.00000 H20 H 0.95770 0.17417 0.02658 1.00000 H21 H 0.04230 0.82583 0.97342 1.00000 H22 H 0.04230 0.67417 0.97342 1.00000 H23 H 0.61954 0.92329 0.89294 1.00000 H24 H 0.61954 0.57671 0.89294 1.00000 H25 H 0.59266 0.41712 0.88887 1.00000 H26 H 0.59266 0.08288 0.88887 1.00000 H27 H 0.79440 0.01778 0.86631 1.00000 H28 H 0.79440 0.48222 0.86631 1.00000 H29 H 0.62688 0.49908 0.79138 1.00000 H30 H 0.62688 0.00092 0.79138 1.00000 H31 H 0.12688 0.99908 0.70862 1.00000 H32 H 0.12688 0.50092 0.70862 1.00000 H33 H 0.29440 0.51778 0.63369 1.00000 H34 H 0.29440 0.98222 0.63369 1.00000 H35 H 0.09266 0.91712 0.61113 1.00000 H36 H 0.09266 0.58288 0.61113 1.00000 H37 H 0.11954 0.42329 0.60706 1.00000 H38 H 0.11954 0.07671 0.60706 1.00000 H39 H 0.54230 0.32583 0.52658 1.00000 H40 H 0.54230 0.17417 0.52658 1.00000 Br1 Br 0.07047 0.25000 0.49339 1.00000 Br2 Br 0.36021 0.49469 0.38559 1.00000 Br3 Br 0.36021 0.00531 0.38559 1.00000 Br4 Br 0.59825 0.25000 0.26440 1.00000 Br5 Br 0.12132 0.25000 0.25052 1.00000 Br6 Br 0.62132 0.75000 0.24948 1.00000 Br7 Br 0.09825 0.75000 0.23560 1.00000 Br8 Br 0.86021 0.99469 0.11441 1.00000 Br9 Br 0.86021 0.50531 0.11441 1.00000 Br10 Br 0.57047 0.75000 0.00661 1.00000 Br11 Br 0.42953 0.25000 0.99339 1.00000 Br12 Br 0.13979 0.49469 0.88559 1.00000 Br13 Br 0.13979 0.00531 0.88559 1.00000 Br14 Br 0.90175 0.25000 0.76440 1.00000 Br15 Br 0.37868 0.25000 0.75052 1.00000 Br16 Br 0.87868 0.75000 0.74948 1.00000 Br17 Br 0.40175 0.75000 0.73560 1.00000 Br18 Br 0.63979 0.99469 0.61441 1.00000 Br19 Br 0.63979 0.50531 0.61441 1.00000 Br20 Br 0.92953 0.75000 0.50661 1.00000 N1 N 0.84230 0.49388 0.36018 1.00000 N2 N 0.84230 0.00612 0.36018 1.00000 N3 N 0.34230 0.99388 0.13982 1.00000 N4 N 0.34230 0.50612 0.13982 1.00000 N5 N 0.65770 0.49388 0.86018 1.00000 N6 N 0.65770 0.00612 0.86018 1.00000 N7 N 0.15770 0.99388 0.63982 1.00000 N8 N 0.15770 0.50612 0.63982 1.00000 O1 O 0.47667 0.75000 0.51148 1.00000 O2 O 0.97667 0.25000 0.98852 1.00000 O3 O 0.02334 0.75000 0.01148 1.00000 O4 O 0.52333 0.25000 0.48852 1.00000