# CIF generated by HEAS from Alexandria entry agm007456597 data_agm007456597 _cell_length_a 4.35954 _cell_length_b 4.62117 _cell_length_c 5.62976 _cell_angle_alpha 111.42009 _cell_angle_beta 89.18520 _cell_angle_gamma 118.64748 _cell_volume 90.84512 _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 Zr1 Zr 0.50000 0.00000 0.50000 1.00000 Mn1 Mn 0.00000 0.00000 0.00000 1.00000 H1 H 0.94899 0.86105 0.33704 1.00000 H2 H 0.64632 0.47526 0.86261 1.00000 H3 H 0.05101 0.13895 0.66296 1.00000 H4 H 0.35368 0.52474 0.13739 1.00000 H5 H 0.58996 0.70374 0.66624 1.00000 H6 H 0.41004 0.29626 0.33376 1.00000 H7 H 0.07953 0.68339 0.67988 1.00000 H8 H 0.92047 0.31661 0.32012 1.00000 Ru1 Ru 0.29629 0.58808 0.85565 1.00000 Ru2 Ru 0.70371 0.41192 0.14435 1.00000