# CIF generated by HEAS from Alexandria entry agm003277828 data_agm003277828 _cell_length_a 9.17151 _cell_length_b 12.99964 _cell_length_c 13.84373 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 1650.53679 _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 Cu1 Cu 0.80464 0.08181 0.25000 1.00000 Cu2 Cu 0.99274 0.63075 0.75000 1.00000 Cu3 Cu 0.80464 0.41819 0.75000 1.00000 Cu4 Cu 0.00726 0.13075 0.75000 1.00000 Cu5 Cu 0.99274 0.86925 0.25000 1.00000 Cu6 Cu 0.00726 0.36925 0.25000 1.00000 Cu7 Cu 0.19536 0.91819 0.75000 1.00000 Cu8 Cu 0.19536 0.58181 0.25000 1.00000 P1 P 0.07082 0.69815 0.61000 1.00000 P2 P 0.92918 0.19815 0.61000 1.00000 P3 P 0.23188 0.66915 0.11288 1.00000 P4 P 0.17921 0.57853 0.52136 1.00000 P5 P 0.55303 0.25497 0.57967 1.00000 P6 P 0.17921 0.92147 0.02136 1.00000 P7 P 0.55303 0.25497 0.92033 1.00000 P8 P 0.44697 0.75497 0.92033 1.00000 P9 P 0.55303 0.24503 0.42033 1.00000 P10 P 0.23188 0.66915 0.38712 1.00000 P11 P 0.92918 0.30185 0.39000 1.00000 P12 P 0.44697 0.74503 0.42033 1.00000 P13 P 0.76812 0.33085 0.61288 1.00000 P14 P 0.92918 0.19815 0.89000 1.00000 P15 P 0.82079 0.07853 0.97864 1.00000 P16 P 0.82079 0.42147 0.02136 1.00000 P17 P 0.76812 0.16915 0.11288 1.00000 P18 P 0.44697 0.75497 0.57967 1.00000 P19 P 0.07082 0.80185 0.39000 1.00000 P20 P 0.44697 0.74503 0.07967 1.00000 P21 P 0.76812 0.33085 0.88712 1.00000 P22 P 0.55303 0.24503 0.07967 1.00000 P23 P 0.07082 0.80185 0.11000 1.00000 P24 P 0.92918 0.30185 0.11000 1.00000 P25 P 0.17921 0.92147 0.47864 1.00000 P26 P 0.82079 0.07853 0.52136 1.00000 P27 P 0.23188 0.83085 0.61288 1.00000 P28 P 0.23188 0.83085 0.88712 1.00000 P29 P 0.17921 0.57853 0.97864 1.00000 P30 P 0.76812 0.16915 0.38712 1.00000 P31 P 0.07082 0.69815 0.89000 1.00000 P32 P 0.82079 0.42147 0.47864 1.00000 Se1 Se 0.39385 0.91415 0.39405 1.00000 Se2 Se 0.90055 0.75000 0.50000 1.00000 Se3 Se 0.60615 0.41415 0.10595 1.00000 Se4 Se 0.90055 0.75000 0.00000 1.00000 Se5 Se 0.60615 0.08585 0.60595 1.00000 Se6 Se 0.39385 0.58585 0.60595 1.00000 Se7 Se 0.39385 0.58585 0.89405 1.00000 Se8 Se 0.60615 0.41415 0.39405 1.00000 Se9 Se 0.09945 0.25000 0.50000 1.00000 Se10 Se 0.39385 0.91415 0.10595 1.00000 Se11 Se 0.60615 0.08585 0.89405 1.00000 Se12 Se 0.09945 0.25000 0.00000 1.00000 Br1 Br 0.27451 0.39993 0.25000 1.00000 Br2 Br 0.92225 0.94616 0.75000 1.00000 Br3 Br 0.92225 0.55384 0.25000 1.00000 Br4 Br 0.07775 0.44616 0.75000 1.00000 Br5 Br 0.07775 0.05384 0.25000 1.00000 Br6 Br 0.72549 0.60007 0.75000 1.00000 Br7 Br 0.72549 0.89993 0.25000 1.00000 Br8 Br 0.27451 0.10007 0.75000 1.00000