# CIF generated by HEAS from Alexandria entry agm080986028 data_agm080986028 _cell_length_a 2.98308 _cell_length_b 4.73848 _cell_length_c 4.28658 _cell_angle_alpha 115.86829 _cell_angle_beta 89.97834 _cell_angle_gamma 90.01157 _cell_volume 54.52064 _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 0.49992 0.43224 0.68710 1.00000 Mn1 Mn 0.99981 0.01975 0.00629 1.00000 H1 H 0.99976 0.18513 0.74083 1.00000 H2 H 0.99964 0.71803 0.08987 1.00000 H3 H 0.99970 0.74626 0.62351 1.00000 H4 H 0.00012 0.37857 0.31860 1.00000 H5 H 0.49983 0.01276 0.23165 1.00000 H6 H 0.49996 0.99501 0.79881 1.00000