# CIF generated by HEAS from Alexandria entry agm004787828 data_agm004787828 _cell_length_a 6.45507 _cell_length_b 6.13334 _cell_length_c 6.13334 _cell_angle_alpha 68.96706 _cell_angle_beta 58.24906 _cell_angle_gamma 58.24906 _cell_volume 174.45143 _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 K1 K 0.00000 0.00000 0.00000 1.00000 Pa1 Pa 0.50000 0.50000 0.50000 1.00000 Ni1 Ni 0.16571 0.33429 0.33429 1.00000 Ni2 Ni 0.83429 0.66571 0.66571 1.00000 Se1 Se 0.49155 0.04153 0.51181 1.00000 Se2 Se 0.04489 0.95847 0.48819 1.00000 Se3 Se 0.95511 0.51181 0.04153 1.00000 Se4 Se 0.50846 0.48819 0.95847 1.00000