# CIF generated by HEAS from Alexandria entry agm010652467 data_agm010652467 _cell_length_a 7.93363 _cell_length_b 8.23258 _cell_length_c 8.67307 _cell_angle_alpha 90.21039 _cell_angle_beta 90.10017 _cell_angle_gamma 89.97606 _cell_volume 566.46985 _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 0.25313 0.25379 0.73411 1.00000 Ba2 Ba 0.24470 0.74434 0.72056 1.00000 Ba3 Ba 0.74185 0.24878 0.75560 1.00000 Ba4 Ba 0.73720 0.74501 0.76097 1.00000 Ba5 Ba 0.73125 0.24484 0.25816 1.00000 Ca1 Ca 0.27647 0.25165 0.31647 1.00000 Ca2 Ca 0.26501 0.71283 0.29994 1.00000 Ca3 Ca 0.70195 0.74666 0.27554 1.00000 Sc1 Sc 0.98794 0.49317 0.50211 1.00000 Sc2 Sc 0.47111 0.99677 0.00787 1.00000 Sc3 Sc 0.47734 0.50475 0.00732 1.00000 Sc4 Sc 0.49773 0.99706 0.49764 1.00000 Sc5 Sc 0.50521 0.49894 0.50086 1.00000 Cr1 Cr 0.01853 0.96439 0.07526 1.00000 Cr2 Cr 0.01780 0.46142 0.03368 1.00000 Cr3 Cr 0.99424 0.99687 0.51363 1.00000 O1 O 0.19778 0.97650 0.96626 1.00000 O2 O 0.20581 0.54763 0.97552 1.00000 O3 O 0.23040 0.02777 0.49859 1.00000 O4 O 0.24463 0.48710 0.48832 1.00000 O5 O 0.82545 0.99915 0.00141 1.00000 O6 O 0.81624 0.52802 0.01904 1.00000 O7 O 0.76916 0.97335 0.44615 1.00000 O8 O 0.74970 0.52597 0.42874 1.00000 O9 O 0.97657 0.98168 0.70532 1.00000 O10 O 0.97318 0.51322 0.72367 1.00000 O11 O 0.04284 0.07840 0.23056 1.00000 O12 O 0.04919 0.43909 0.22368 1.00000 O13 O 0.50131 0.99131 0.74823 1.00000 O14 O 0.50639 0.50743 0.75010 1.00000 O15 O 0.46829 0.01167 0.24210 1.00000 O16 O 0.45783 0.49142 0.23691 1.00000 O17 O 0.01669 0.27402 0.96716 1.00000 O18 O 0.00944 0.77705 0.14187 1.00000 O19 O 0.97395 0.22978 0.49957 1.00000 O20 O 0.03207 0.77613 0.46309 1.00000 O21 O 0.50588 0.25028 0.99010 1.00000 O22 O 0.53165 0.75292 0.01954 1.00000 O23 O 0.51255 0.24829 0.49870 1.00000 O24 O 0.48152 0.75055 0.47565 1.00000