# CIF generated by HEAS from Alexandria entry agm006276830 data_agm006276830 _cell_length_a 7.00248 _cell_length_b 7.40404 _cell_length_c 14.62695 _cell_angle_alpha 90.00000 _cell_angle_beta 99.34847 _cell_angle_gamma 90.00000 _cell_volume 748.28739 _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 Nd1 Nd 0.87485 0.75000 0.46094 1.00000 Nd2 Nd 0.12515 0.25000 0.53906 1.00000 Nd3 Nd 0.24854 0.75000 0.87933 1.00000 Nd4 Nd 0.75146 0.25000 0.12067 1.00000 Mo1 Mo 0.71228 0.99607 0.86089 1.00000 Mo2 Mo 0.28772 0.49607 0.13911 1.00000 Mo3 Mo 0.28772 0.00393 0.13911 1.00000 Mo4 Mo 0.71228 0.50393 0.86089 1.00000 Mo5 Mo 0.64204 0.25000 0.67062 1.00000 Mo6 Mo 0.35796 0.75000 0.32938 1.00000 H1 H 0.73755 0.64455 0.64818 1.00000 H2 H 0.26245 0.14455 0.35182 1.00000 H3 H 0.26245 0.35545 0.35182 1.00000 H4 H 0.73755 0.85545 0.64818 1.00000 Se1 Se 0.28657 0.75000 0.61620 1.00000 Se2 Se 0.71343 0.25000 0.38380 1.00000 Se3 Se 0.26013 0.25000 0.80906 1.00000 Se4 Se 0.73987 0.75000 0.19094 1.00000 O1 O 0.14866 0.92429 0.55700 1.00000 O2 O 0.85134 0.42429 0.44300 1.00000 O3 O 0.85134 0.07571 0.44300 1.00000 O4 O 0.14866 0.57571 0.55700 1.00000 O5 O 0.21276 0.75000 0.72146 1.00000 O6 O 0.78724 0.25000 0.27854 1.00000 O7 O 0.31679 0.25000 0.69974 1.00000 O8 O 0.68321 0.75000 0.30026 1.00000 O9 O 0.39225 0.06219 0.85643 1.00000 O10 O 0.60775 0.56219 0.14357 1.00000 O11 O 0.60775 0.93781 0.14357 1.00000 O12 O 0.39225 0.43781 0.85643 1.00000 O13 O 0.60264 0.75000 0.86590 1.00000 O14 O 0.39736 0.25000 0.13410 1.00000 O15 O 0.73338 0.06115 0.97841 1.00000 O16 O 0.26662 0.56115 0.02159 1.00000 O17 O 0.26662 0.93885 0.02159 1.00000 O18 O 0.73338 0.43885 0.97841 1.00000 O19 O 0.95162 0.92933 0.85553 1.00000 O20 O 0.04838 0.42933 0.14447 1.00000 O21 O 0.04838 0.07067 0.14447 1.00000 O22 O 0.95162 0.57067 0.85553 1.00000 O23 O 0.63267 0.00659 0.71568 1.00000 O24 O 0.36733 0.50659 0.28432 1.00000 O25 O 0.36733 0.99341 0.28432 1.00000 O26 O 0.63267 0.49341 0.71568 1.00000 O27 O 0.73357 0.25000 0.82369 1.00000 O28 O 0.26643 0.75000 0.17631 1.00000 O29 O 0.87851 0.25000 0.64157 1.00000 O30 O 0.12149 0.75000 0.35843 1.00000 O31 O 0.49277 0.25000 0.56048 1.00000 O32 O 0.50723 0.75000 0.43952 1.00000 O33 O 0.77977 0.75000 0.61434 1.00000 O34 O 0.22023 0.25000 0.38566 1.00000