# CIF generated by HEAS from Alexandria entry agm004952011 data_agm004952011 _cell_length_a 5.31509 _cell_length_b 5.21292 _cell_length_c 5.62977 _cell_angle_alpha 62.58209 _cell_angle_beta 61.34805 _cell_angle_gamma 60.20192 _cell_volume 113.61669 _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 0.52169 0.52099 0.43205 1.00000 Sc2 Sc 0.01067 0.02470 0.93886 1.00000 V1 V 0.31878 0.31302 0.04841 1.00000 Fe1 Fe 0.81270 0.80155 0.57334 1.00000 O1 O 0.58895 0.22704 0.24152 1.00000 O2 O 0.22868 0.95373 0.23879 1.00000 O3 O 0.93760 0.59918 0.25510 1.00000 O4 O 0.40828 0.69354 0.77052 1.00000 O5 O 0.70960 0.11859 0.75318 1.00000 O6 O 0.12463 0.40927 0.76343 1.00000