# CIF generated by HEAS from Alexandria entry agm004707362 data_agm004707362 _cell_length_a 6.64444 _cell_length_b 6.64444 _cell_length_c 6.64444 _cell_angle_alpha 105.39089 _cell_angle_beta 105.39089 _cell_angle_gamma 105.39089 _cell_volume 254.26104 _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 0.00000 0.00000 0.00000 1.00000 Ni1 Ni 0.57722 0.42278 0.00000 1.00000 Ni2 Ni 0.42278 0.00000 0.57722 1.00000 Ni3 Ni 0.00000 0.57722 0.42278 1.00000 Se1 Se 0.89764 0.10236 0.50000 1.00000 Se2 Se 0.10236 0.50000 0.89764 1.00000 Se3 Se 0.50000 0.89764 0.10236 1.00000 Se4 Se 0.50000 0.50000 0.50000 1.00000 O1 O 0.50000 0.32657 0.67343 1.00000 O2 O 0.93946 0.50000 0.06054 1.00000 O3 O 0.06054 0.93946 0.50000 1.00000 O4 O 0.50000 0.06054 0.93946 1.00000 O5 O 0.34253 0.01372 0.25753 1.00000 O6 O 0.25753 0.34253 0.01372 1.00000 O7 O 0.01372 0.25753 0.34253 1.00000 O8 O 0.65747 0.74247 0.98628 1.00000 O9 O 0.98628 0.65747 0.74247 1.00000 O10 O 0.74247 0.98628 0.65747 1.00000 O11 O 0.67343 0.50000 0.32657 1.00000 O12 O 0.32657 0.67343 0.50000 1.00000