# CIF generated by HEAS from Alexandria entry agm007686012 data_agm007686012 _cell_length_a 5.78051 _cell_length_b 5.78051 _cell_length_c 5.78051 _cell_angle_alpha 47.70508 _cell_angle_beta 47.70508 _cell_angle_gamma 47.70508 _cell_volume 96.75422 _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 Cr1 Cr 0.14445 0.14445 0.14445 1.00000 Cr2 Cr 0.85555 0.85555 0.85555 1.00000 H1 H 0.98067 0.35548 0.35548 1.00000 H2 H 0.35548 0.35548 0.98067 1.00000 H3 H 0.64452 0.01933 0.64452 1.00000 H4 H 0.01933 0.64452 0.64452 1.00000 H5 H 0.64452 0.64452 0.01933 1.00000 H6 H 0.35548 0.98067 0.35548 1.00000 S1 S 0.00000 0.00000 0.00000 1.00000