# CIF generated by HEAS from Alexandria entry agm080887294 data_agm080887294 _cell_length_a 3.78727 _cell_length_b 3.79316 _cell_length_c 4.59197 _cell_angle_alpha 106.02427 _cell_angle_beta 130.65230 _cell_angle_gamma 83.42132 _cell_volume 47.90999 _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 Sc1 Sc 0.00000 0.50000 0.50000 1.00000 B1 B 0.50000 0.00000 0.50000 1.00000 H1 H 0.62942 0.73361 0.69243 1.00000 H2 H 0.96017 0.06456 0.69239 1.00000 H3 H 0.03983 0.93544 0.30761 1.00000 H4 H 0.37058 0.26639 0.30757 1.00000 H5 H 0.59692 0.26119 0.85517 1.00000 H6 H 0.40308 0.73881 0.14483 1.00000