# CIF generated by HEAS from Alexandria entry agm004877611 data_agm004877611 _cell_length_a 4.94427 _cell_length_b 4.94427 _cell_length_c 7.84155 _cell_angle_alpha 86.29822 _cell_angle_beta 86.29822 _cell_angle_gamma 63.91708 _cell_volume 171.67147 _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 Ba1 Ba 0.00000 0.00000 0.50000 1.00000 Ni1 Ni 0.00000 0.00000 0.00000 1.00000 S1 S 0.63175 0.63175 0.20832 1.00000 S2 S 0.36825 0.36825 0.79168 1.00000 O1 O 0.70370 0.23771 0.80610 1.00000 O2 O 0.76198 0.76198 0.07431 1.00000 O3 O 0.68624 0.68624 0.38619 1.00000 O4 O 0.31376 0.31376 0.61381 1.00000 O5 O 0.23802 0.23802 0.92569 1.00000 O6 O 0.23771 0.70370 0.80610 1.00000 O7 O 0.76229 0.29630 0.19390 1.00000 O8 O 0.29630 0.76229 0.19390 1.00000