# CIF generated by HEAS from Alexandria entry agm005706512 data_agm005706512 _cell_length_a 4.04622 _cell_length_b 3.72988 _cell_length_c 5.33993 _cell_angle_alpha 69.55890 _cell_angle_beta 88.76928 _cell_angle_gamma 90.00000 _cell_volume 75.49548 _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 Pa1 Pa 0.56259 0.51108 0.97784 1.00000 Ni1 Ni 0.31925 0.78456 0.43088 1.00000 S1 S 0.06589 0.97356 0.05287 1.00000 S2 S 0.55227 0.23080 0.53840 1.00000