# CIF generated by HEAS from Alexandria entry agm007175949 data_agm007175949 _cell_length_a 5.90528 _cell_length_b 5.90528 _cell_length_c 5.90528 _cell_angle_alpha 53.95711 _cell_angle_beta 53.95711 _cell_angle_gamma 53.95711 _cell_volume 125.05904 _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 Ni1 Ni 0.00000 0.00000 0.00000 1.00000 H1 H 0.23691 0.23691 0.23691 1.00000 H2 H 0.32004 0.67996 0.00000 1.00000 H3 H 0.76309 0.76309 0.76309 1.00000 H4 H 0.67996 0.00000 0.32004 1.00000 H5 H 0.32004 0.00000 0.67996 1.00000 H6 H 0.00000 0.32004 0.67996 1.00000 H7 H 0.00000 0.67996 0.32004 1.00000 H8 H 0.67996 0.32004 0.00000 1.00000 Ir1 Ir 0.34321 0.34321 0.34321 1.00000 Ir2 Ir 0.65679 0.65679 0.65679 1.00000 S1 S 0.50000 0.50000 0.50000 1.00000