# CIF generated by HEAS from Alexandria entry agm005102425 data_agm005102425 _cell_length_a 5.51027 _cell_length_b 5.51027 _cell_length_c 9.88387 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 300.10534 _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 0.20963 0.79037 0.50563 1.00000 Sc2 Sc 0.79037 0.20963 0.50563 1.00000 Sc3 Sc 0.29037 0.29037 0.00563 1.00000 Sc4 Sc 0.70963 0.70963 0.00563 1.00000 Sc5 Sc 0.21314 0.78686 0.16120 1.00000 Sc6 Sc 0.78686 0.21314 0.16120 1.00000 Sc7 Sc 0.28686 0.28686 0.66120 1.00000 Sc8 Sc 0.71314 0.71314 0.66120 1.00000 Sc9 Sc 0.80525 0.19475 0.83149 1.00000 Sc10 Sc 0.19475 0.80525 0.83149 1.00000 Sc11 Sc 0.69475 0.69475 0.33149 1.00000 Sc12 Sc 0.30525 0.30525 0.33149 1.00000 H1 H 0.50000 0.50000 0.83637 1.00000 H2 H 0.00000 0.00000 0.33637 1.00000 C1 C 0.50000 0.50000 0.50282 1.00000 C2 C 0.00000 0.00000 0.00282 1.00000 N1 N 0.50000 0.50000 0.16418 1.00000 N2 N 0.00000 0.00000 0.66418 1.00000