# CIF generated by HEAS from Alexandria entry agm080271159 data_agm080271159 _cell_length_a 6.66432 _cell_length_b 4.41023 _cell_length_c 4.57973 _cell_angle_alpha 66.85971 _cell_angle_beta 55.57427 _cell_angle_gamma 68.56906 _cell_volume 100.26002 _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 0.36105 0.48200 0.40140 1.00000 Si1 Si 0.97269 0.94450 0.05656 1.00000 H1 H 0.32165 0.13054 0.06446 1.00000 H2 H 0.71640 0.91623 0.14936 1.00000 H3 H 0.63015 0.34096 0.73693 1.00000 H4 H 0.68460 0.50160 0.63123 1.00000 H5 H 0.90811 0.85593 0.45583 1.00000 H6 H 0.90535 0.32824 0.00423 1.00000