# CIF generated by HEAS from Alexandria entry agm005229843 data_agm005229843 _cell_length_a 4.51968 _cell_length_b 9.83077 _cell_length_c 10.89434 _cell_angle_alpha 87.73300 _cell_angle_beta 81.47265 _cell_angle_gamma 80.56251 _cell_volume 472.16899 _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 B1 B 0.13455 0.69945 0.26801 1.00000 B2 B 0.86545 0.30055 0.73199 1.00000 B3 B 0.83886 0.69965 0.48140 1.00000 B4 B 0.16114 0.30035 0.51860 1.00000 B5 B 0.81950 0.91053 0.35822 1.00000 B6 B 0.18050 0.08947 0.64178 1.00000 P1 P 0.70100 0.64618 0.12724 1.00000 P2 P 0.29900 0.35382 0.87276 1.00000 H1 H 0.15319 0.22619 0.11868 1.00000 H2 H 0.84681 0.77381 0.88132 1.00000 H3 H 0.17327 0.46211 0.40101 1.00000 H4 H 0.82673 0.53789 0.59899 1.00000 H5 H 0.84082 0.32447 0.18464 1.00000 H6 H 0.15918 0.67553 0.81536 1.00000 H7 H 0.44452 0.91205 0.58451 1.00000 H8 H 0.55548 0.08795 0.41549 1.00000 H9 H 0.91198 0.16005 0.23912 1.00000 H10 H 0.08802 0.83995 0.76088 1.00000 H11 H 0.12268 0.27906 0.26922 1.00000 H12 H 0.87732 0.72094 0.73078 1.00000 H13 H 0.72833 0.47017 0.00288 1.00000 H14 H 0.27167 0.52983 0.99712 1.00000 N1 N 0.00862 0.24499 0.20348 1.00000 N2 N 0.99138 0.75501 0.79652 1.00000 O1 O 0.47178 0.67049 0.24859 1.00000 O2 O 0.52822 0.32951 0.75141 1.00000 O3 O 0.68700 0.48829 0.09251 1.00000 O4 O 0.31300 0.51171 0.90749 1.00000 O5 O 0.02585 0.63052 0.16618 1.00000 O6 O 0.97415 0.36948 0.83382 1.00000 O7 O 0.64524 0.74214 0.02101 1.00000 O8 O 0.35476 0.25786 0.97899 1.00000 O9 O 0.02572 0.84602 0.26781 1.00000 O10 O 0.97428 0.15398 0.73219 1.00000 O11 O 0.03794 0.63164 0.38849 1.00000 O12 O 0.96206 0.36836 0.61151 1.00000 O13 O 0.24902 0.36058 0.40635 1.00000 O14 O 0.75098 0.63942 0.59365 1.00000 O15 O 0.29083 0.95189 0.65405 1.00000 O16 O 0.70917 0.04811 0.34595 1.00000 O17 O 0.72050 0.83944 0.46783 1.00000 O18 O 0.27950 0.16056 0.53217 1.00000 O19 O 0.00000 0.00000 0.00000 1.00000