# CIF generated by HEAS from Alexandria entry agm003104147 data_agm003104147 _cell_length_a 5.06690 _cell_length_b 5.93599 _cell_length_c 5.69276 _cell_angle_alpha 114.62012 _cell_angle_beta 77.82059 _cell_angle_gamma 80.64439 _cell_volume 145.98415 _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 0.66731 0.59935 0.34887 1.00000 Ca2 Ca 0.09606 0.80825 0.94765 1.00000 Tc1 Tc 0.67832 0.21449 0.74109 1.00000 Tc2 Tc 0.20443 0.17880 0.54771 1.00000 N1 N 0.59076 0.08505 0.99472 1.00000 N2 N 0.98079 0.89369 0.41827 1.00000 N3 N 0.17547 0.82712 0.52376 1.00000 N4 N 0.42523 0.05376 0.16707 1.00000 N5 N 0.47020 0.41648 0.63695 1.00000 N6 N 0.92703 0.44328 0.87480 1.00000