# CIF generated by HEAS from Alexandria entry agm011099005 data_agm011099005 _cell_length_a 8.81987 _cell_length_b 12.45261 _cell_length_c 12.84203 _cell_angle_alpha 95.59795 _cell_angle_beta 105.96693 _cell_angle_gamma 98.03873 _cell_volume 1328.93153 _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 0.05937 0.18740 0.80469 1.00000 Ba2 Ba 0.62918 0.04400 0.80499 1.00000 Ba3 Ba 0.48791 0.32933 0.80644 1.00000 Ba4 Ba 0.08305 0.52767 0.19383 1.00000 Ba5 Ba 0.34649 0.61559 0.80675 1.00000 Ba6 Ba 0.22496 0.24109 0.19258 1.00000 Ba7 Ba 0.20380 0.90041 0.80501 1.00000 Ba8 Ba 0.77352 0.75697 0.80511 1.00000 Ba9 Ba 0.65430 0.38474 0.19362 1.00000 Ba10 Ba 0.79855 0.09906 0.19364 1.00000 Ba11 Ba 0.36708 0.95649 0.19376 1.00000 Ba12 Ba 0.91718 0.47238 0.80685 1.00000 Ba13 Ba 0.51145 0.67025 0.19470 1.00000 Ba14 Ba 0.94137 0.81382 0.19372 1.00000 Li1 Li 0.85945 0.95316 0.67203 1.00000 La1 La 0.21490 0.57149 0.49946 1.00000 La2 La 0.35606 0.28569 0.49911 1.00000 La3 La 0.50504 0.99923 0.50253 1.00000 La4 La 0.06864 0.85836 0.50262 1.00000 La5 La 0.78548 0.42837 0.49928 1.00000 La6 La 0.92676 0.14039 0.50254 1.00000 La7 La 0.64666 0.71758 0.50291 1.00000 Cu1 Cu 0.99603 0.99906 0.99038 1.00000 Cu2 Cu 0.14355 0.71388 0.00069 1.00000 Cu3 Cu 0.42961 0.14336 0.00120 1.00000 Cu4 Cu 0.28514 0.42850 0.99998 1.00000 Cu5 Cu 0.01007 0.33618 0.35755 1.00000 Cu6 Cu 0.13207 0.37854 0.64189 1.00000 Cu7 Cu 0.15427 0.05109 0.35995 1.00000 Cu8 Cu 0.27321 0.09190 0.63926 1.00000 Cu9 Cu 0.41787 0.80542 0.63966 1.00000 Cu10 Cu 0.70213 0.23478 0.64002 1.00000 Cu11 Cu 0.29622 0.76591 0.35844 1.00000 Cu12 Cu 0.43948 0.48002 0.35793 1.00000 Cu13 Cu 0.85705 0.28610 0.00075 1.00000 Cu14 Cu 0.57193 0.85733 0.00202 1.00000 Cu15 Cu 0.71505 0.57154 0.00050 1.00000 Cu16 Cu 0.56107 0.51936 0.64186 1.00000 Cu17 Cu 0.58141 0.19333 0.35701 1.00000 Cu18 Cu 0.72269 0.90749 0.35320 1.00000 Cu19 Cu 0.86747 0.62283 0.35743 1.00000 Cu20 Cu 0.98917 0.66221 0.64020 1.00000 O1 O 0.06095 0.02073 0.62750 1.00000 O2 O 0.19800 0.23486 0.63017 1.00000 O3 O 0.36519 0.12252 0.85396 1.00000 O4 O 0.05926 0.01989 0.13795 1.00000 O5 O 0.08069 0.69289 0.85336 1.00000 O6 O 0.05466 0.51985 0.62857 1.00000 O7 O 0.08721 0.19494 0.36994 1.00000 O8 O 0.22292 0.40848 0.85238 1.00000 O9 O 0.08708 0.69577 0.36992 1.00000 O10 O 0.34116 0.44708 0.62909 1.00000 O11 O 0.20458 0.73380 0.63148 1.00000 O12 O 0.47943 0.16101 0.63103 1.00000 O13 O 0.22959 0.40978 0.36901 1.00000 O14 O 0.37186 0.12393 0.36898 1.00000 O15 O 0.34237 0.94753 0.63214 1.00000 O16 O 0.62689 0.37403 0.62849 1.00000 O17 O 0.49306 0.16408 0.14880 1.00000 O18 O 0.76594 0.09467 0.62781 1.00000 O19 O 0.48535 0.65983 0.63082 1.00000 O20 O 0.65086 0.54954 0.85289 1.00000 O21 O 0.51558 0.33835 0.36983 1.00000 O22 O 0.51017 0.83619 0.85477 1.00000 O23 O 0.37328 0.62474 0.37089 1.00000 O24 O 0.65843 0.05221 0.36976 1.00000 O25 O 0.23015 0.91045 0.37088 1.00000 O26 O 0.20621 0.73525 0.14821 1.00000 O27 O 0.79372 0.26518 0.85339 1.00000 O28 O 0.34851 0.44894 0.14761 1.00000 O29 O 0.51529 0.83830 0.36892 1.00000 O30 O 0.62004 0.87308 0.62795 1.00000 O31 O 0.91473 0.30618 0.63199 1.00000 O32 O 0.80126 0.26705 0.37001 1.00000 O33 O 0.76982 0.58860 0.63211 1.00000 O34 O 0.65879 0.55280 0.36999 1.00000 O35 O 0.63480 0.87850 0.14976 1.00000 O36 O 0.91519 0.79898 0.62800 1.00000 O37 O 0.93222 0.97753 0.84139 1.00000 O38 O 0.77820 0.59297 0.14809 1.00000 O39 O 0.92065 0.30692 0.14835 1.00000 O40 O 0.94441 0.48145 0.36990 1.00000 O41 O 0.80118 0.76759 0.36980 1.00000 O42 O 0.94359 0.98123 0.36802 1.00000