# CIF generated by HEAS from Alexandria entry agm007486451 data_agm007486451 _cell_length_a 5.22991 _cell_length_b 5.22991 _cell_length_c 5.26566 _cell_angle_alpha 63.40123 _cell_angle_beta 63.40123 _cell_angle_gamma 40.94853 _cell_volume 82.91345 _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 Nb1 Nb 0.50000 0.50000 0.50000 1.00000 Al1 Al 0.00000 0.00000 0.00000 1.00000 Ni1 Ni 0.27696 0.27696 0.15099 1.00000 Ni2 Ni 0.72304 0.72304 0.84901 1.00000 H1 H 0.11283 0.11283 0.48618 1.00000 H2 H 0.87712 0.37732 0.12686 1.00000 H3 H 0.88717 0.88717 0.51382 1.00000 H4 H 0.37732 0.87712 0.12686 1.00000 H5 H 0.62268 0.12288 0.87314 1.00000 H6 H 0.34571 0.34571 0.36692 1.00000 H7 H 0.65429 0.65429 0.63308 1.00000 H8 H 0.12288 0.62268 0.87314 1.00000