# CIF generated by HEAS from Alexandria entry agm021978430 data_agm021978430 _cell_length_a 10.50013 _cell_length_b 12.71854 _cell_length_c 16.46198 _cell_angle_alpha 90.00000 _cell_angle_beta 90.00000 _cell_angle_gamma 90.00000 _cell_volume 2198.43640 _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 0.25000 0.37790 0.63859 1.00000 Nd2 Nd 0.96449 0.61821 0.88842 1.00000 Nd3 Nd 0.25000 0.11596 0.12401 1.00000 Nd4 Nd 0.46449 0.38179 0.11158 1.00000 Nd5 Nd 0.25000 0.87790 0.86141 1.00000 Nd6 Nd 0.53551 0.61821 0.88842 1.00000 Nd7 Nd 0.25000 0.61596 0.37599 1.00000 Nd8 Nd 0.54322 0.31191 0.40583 1.00000 Nd9 Nd 0.04322 0.68809 0.59417 1.00000 Nd10 Nd 0.95678 0.31191 0.40583 1.00000 Nd11 Nd 0.45678 0.18809 0.90583 1.00000 Nd12 Nd 0.95678 0.81191 0.09417 1.00000 Nd13 Nd 0.45678 0.68809 0.59417 1.00000 Nd14 Nd 0.03551 0.38179 0.11158 1.00000 Nd15 Nd 0.96449 0.11821 0.61158 1.00000 Nd16 Nd 0.53551 0.11821 0.61158 1.00000 Nd17 Nd 0.75000 0.12210 0.13859 1.00000 Nd18 Nd 0.04322 0.18809 0.90583 1.00000 Nd19 Nd 0.46449 0.88179 0.38842 1.00000 Nd20 Nd 0.03551 0.88179 0.38842 1.00000 Nd21 Nd 0.75000 0.88404 0.87599 1.00000 Nd22 Nd 0.54322 0.81191 0.09417 1.00000 Nd23 Nd 0.75000 0.38404 0.62401 1.00000 Nd24 Nd 0.75000 0.62210 0.36141 1.00000 Ge1 Ge 0.25000 0.33614 0.27826 1.00000 Ge2 Ge 0.25000 0.83614 0.22174 1.00000 Ge3 Ge 0.75000 0.16386 0.77826 1.00000 Ge4 Ge 0.25000 0.61901 0.75780 1.00000 Ge5 Ge 0.75000 0.88099 0.25780 1.00000 Ge6 Ge 0.75000 0.66386 0.72174 1.00000 Ge7 Ge 0.25000 0.11901 0.74220 1.00000 Ge8 Ge 0.75000 0.38099 0.24220 1.00000 S1 S 0.75000 0.01776 0.70469 1.00000 S2 S 0.00998 0.34171 0.56889 1.00000 S3 S 0.75000 0.61447 0.59268 1.00000 S4 S 0.25000 0.06427 0.95239 1.00000 S5 S 0.57604 0.97242 0.22760 1.00000 S6 S 0.50998 0.65829 0.43111 1.00000 S7 S 0.25000 0.98224 0.29531 1.00000 S8 S 0.41526 0.73648 0.25567 1.00000 S9 S 0.99002 0.15829 0.06889 1.00000 S10 S 0.49002 0.34171 0.56889 1.00000 S11 S 0.75000 0.68823 0.97012 1.00000 S12 S 0.25000 0.56427 0.54761 1.00000 S13 S 0.25000 0.48224 0.20469 1.00000 S14 S 0.08474 0.23648 0.24433 1.00000 S15 S 0.42396 0.52758 0.72760 1.00000 S16 S 0.25000 0.77689 0.69509 1.00000 S17 S 0.75000 0.22311 0.30491 1.00000 S18 S 0.75000 0.35243 0.10914 1.00000 S19 S 0.75000 0.85243 0.39086 1.00000 S20 S 0.07604 0.52758 0.72760 1.00000 S21 S 0.25000 0.64757 0.89086 1.00000 S22 S 0.75000 0.18823 0.52988 1.00000 S23 S 0.92396 0.47242 0.27240 1.00000 S24 S 0.08474 0.73648 0.25567 1.00000 S25 S 0.99002 0.65829 0.43111 1.00000 S26 S 0.75000 0.43573 0.45239 1.00000 S27 S 0.75000 0.11447 0.90732 1.00000 S28 S 0.25000 0.14757 0.60914 1.00000 S29 S 0.50998 0.15829 0.06889 1.00000 S30 S 0.25000 0.88553 0.09268 1.00000 S31 S 0.25000 0.38553 0.40732 1.00000 S32 S 0.92396 0.97242 0.22760 1.00000 S33 S 0.25000 0.81177 0.47012 1.00000 S34 S 0.00998 0.84171 0.93111 1.00000 S35 S 0.42396 0.02758 0.77240 1.00000 S36 S 0.58474 0.26352 0.74433 1.00000 S37 S 0.41526 0.23648 0.24433 1.00000 S38 S 0.58474 0.76352 0.75567 1.00000 S39 S 0.75000 0.93573 0.04761 1.00000 S40 S 0.07604 0.02758 0.77240 1.00000 S41 S 0.25000 0.27689 0.80491 1.00000 S42 S 0.91526 0.26352 0.74433 1.00000 S43 S 0.49002 0.84171 0.93111 1.00000 S44 S 0.57604 0.47242 0.27240 1.00000 S45 S 0.91526 0.76352 0.75567 1.00000 S46 S 0.75000 0.51776 0.79531 1.00000 S47 S 0.25000 0.31177 0.02988 1.00000 S48 S 0.75000 0.72311 0.19509 1.00000 Cl1 Cl 0.95986 0.89700 0.55999 1.00000 Cl2 Cl 0.54014 0.39700 0.94001 1.00000 Cl3 Cl 0.54014 0.89700 0.55999 1.00000 Cl4 Cl 0.04014 0.10300 0.44001 1.00000 Cl5 Cl 0.95986 0.39700 0.94001 1.00000 Cl6 Cl 0.45986 0.10300 0.44001 1.00000 Cl7 Cl 0.04014 0.60300 0.05999 1.00000 Cl8 Cl 0.45986 0.60300 0.05999 1.00000