# CIF generated by HEAS from Alexandria entry agm010794480 data_agm010794480 _cell_length_a 5.38948 _cell_length_b 5.53290 _cell_length_c 7.67194 _cell_angle_alpha 90.20567 _cell_angle_beta 90.38223 _cell_angle_gamma 90.11398 _cell_volume 228.76608 _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 Ca1 Ca 0.48490 0.45059 0.24925 1.00000 Ca2 Ca 0.01221 0.95294 0.24858 1.00000 Ca3 Ca 0.51176 0.55011 0.75003 1.00000 Y1 Y 0.98693 0.05919 0.74955 1.00000 Sc1 Sc 0.99894 0.50569 0.49465 1.00000 Sc2 Sc 0.50074 0.99616 0.00410 1.00000 Ni1 Ni 0.00104 0.50131 0.99762 1.00000 Ni2 Ni 0.49884 0.99980 0.50315 1.00000 O1 O 0.69974 0.27259 0.55357 1.00000 O2 O 0.81418 0.78599 0.94865 1.00000 O3 O 0.28323 0.69431 0.04048 1.00000 O4 O 0.21444 0.19329 0.46542 1.00000 O5 O 0.30946 0.72091 0.45523 1.00000 O6 O 0.18965 0.21783 0.03802 1.00000 O7 O 0.72558 0.29604 0.95066 1.00000 O8 O 0.78428 0.80776 0.55023 1.00000 O9 O 0.58151 0.02541 0.26658 1.00000 O10 O 0.91493 0.52502 0.23455 1.00000 O11 O 0.40328 0.97486 0.73875 1.00000 O12 O 0.08435 0.47020 0.76093 1.00000