data_mlrutgersmine_0m _audit_creation_method SHELXL-97 _chemical_name_systematic ; ? ; _chemical_name_common ? _chemical_melting_point ? _chemical_formula_moiety ? _chemical_formula_sum 'Ca10 Ce Cl Eu F O24 P6' _chemical_formula_weight 1317.15 loop_ _atom_type_symbol _atom_type_description _atom_type_scat_dispersion_real _atom_type_scat_dispersion_imag _atom_type_scat_source 'O' 'O' 0.0106 0.0060 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'F' 'F' 0.0171 0.0103 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'P' 'P' 0.1023 0.0942 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Cl' 'Cl' 0.1484 0.1585 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Ca' 'Ca' 0.2262 0.3064 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Ce' 'Ce' -0.2486 2.6331 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' 'Eu' 'Eu' -0.1578 3.6682 'International Tables Vol C Tables 4.2.6.8 and 6.1.1.4' _symmetry_cell_setting ? _symmetry_space_group_name_H-M ? loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-y, x-y, z' '-x+y, -x, z' '-x, -y, z+1/2' 'y, -x+y, z+1/2' 'x-y, x, z+1/2' '-x, -y, -z' 'y, -x+y, -z' 'x-y, x, -z' 'x, y, -z-1/2' '-y, x-y, -z-1/2' '-x+y, -x, -z-1/2' _cell_length_a 9.3888(5) _cell_length_b 9.3888(5) _cell_length_c 6.8862(4) _cell_angle_alpha 90.00 _cell_angle_beta 90.00 _cell_angle_gamma 120.00 _cell_volume 525.69(5) _cell_formula_units_Z 1 _cell_measurement_temperature 296(2) _cell_measurement_reflns_used ? _cell_measurement_theta_min ? _cell_measurement_theta_max ? _exptl_crystal_description ? _exptl_crystal_colour ? _exptl_crystal_size_max ? _exptl_crystal_size_mid ? _exptl_crystal_size_min ? _exptl_crystal_density_meas ? _exptl_crystal_density_diffrn 4.161 _exptl_crystal_density_method 'not measured' _exptl_crystal_F_000 629 _exptl_absorpt_coefficient_mu 8.250 _exptl_absorpt_correction_type ? _exptl_absorpt_correction_T_min ? _exptl_absorpt_correction_T_max ? _exptl_absorpt_process_details ? _exptl_special_details ; ? ; _diffrn_ambient_temperature 296(2) _diffrn_radiation_wavelength 0.71073 _diffrn_radiation_type MoK\a _diffrn_radiation_source 'fine-focus sealed tube' _diffrn_radiation_monochromator graphite _diffrn_measurement_device_type ? _diffrn_measurement_method ? _diffrn_detector_area_resol_mean ? _diffrn_reflns_number 11332 _diffrn_reflns_av_R_equivalents 0.0142 _diffrn_reflns_av_sigmaI/netI 0.0057 _diffrn_reflns_limit_h_min -13 _diffrn_reflns_limit_h_max 14 _diffrn_reflns_limit_k_min -13 _diffrn_reflns_limit_k_max 14 _diffrn_reflns_limit_l_min -10 _diffrn_reflns_limit_l_max 10 _diffrn_reflns_theta_min 2.50 _diffrn_reflns_theta_max 33.00 _reflns_number_total 700 _reflns_number_gt 697 _reflns_threshold_expression >2sigma(I) _computing_data_collection ? _computing_cell_refinement ? _computing_data_reduction ? _computing_structure_solution 'SHELXS-97 (Sheldrick, 2008)' _computing_structure_refinement 'SHELXL-97 (Sheldrick, 2008)' _computing_molecular_graphics ? _computing_publication_material ? _refine_special_details ; Refinement of F^2^ against ALL reflections. The weighted R-factor wR and goodness of fit S are based on F^2^, conventional R-factors R are based on F, with F set to zero for negative F^2^. The threshold expression of F^2^ > 2sigma(F^2^) is used only for calculating R-factors(gt) etc. and is not relevant to the choice of reflections for refinement. R-factors based on F^2^ are statistically about twice as large as those based on F, and R- factors based on ALL data will be even larger. ; _refine_ls_structure_factor_coef Fsqd _refine_ls_matrix_type full _refine_ls_weighting_scheme calc _refine_ls_weighting_details 'calc w=1/[\s^2^(Fo^2^)+(0.0159P)^2^+0.3625P] where P=(Fo^2^+2Fc^2^)/3' _atom_sites_solution_primary direct _atom_sites_solution_secondary difmap _atom_sites_solution_hydrogens geom _refine_ls_hydrogen_treatment mixed _refine_ls_extinction_method SHELXL _refine_ls_extinction_coef 0.0078(10) _refine_ls_extinction_expression 'Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^' _refine_ls_number_reflns 700 _refine_ls_number_parameters 45 _refine_ls_number_restraints 0 _refine_ls_R_factor_all 0.0156 _refine_ls_R_factor_gt 0.0155 _refine_ls_wR_factor_ref 0.0404 _refine_ls_wR_factor_gt 0.0403 _refine_ls_goodness_of_fit_ref 1.242 _refine_ls_restrained_S_all 1.242 _refine_ls_shift/su_max 0.000 _refine_ls_shift/su_mean 0.000 loop_ _atom_site_label _atom_site_type_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_occupancy _atom_site_symmetry_multiplicity _atom_site_calc_flag _atom_site_refinement_flags _atom_site_disorder_assembly _atom_site_disorder_group Ca1 Ca 0.6667 0.3333 0.00108(5) 0.01049(9) Uani 1 3 d S . . Ca2 Ca 0.24912(3) 0.24196(3) 0.2500 0.00955(10) Uani 0.9902(9) 2 d SP . . Eu2 Eu 0.24912(3) 0.24196(3) 0.2500 0.00955(10) Uani 0.0098(9) 2 d SP . . P P 0.36886(4) -0.02935(4) 0.2500 0.00652(9) Uani 1 2 d S . . O1 O 0.48439(13) 0.15793(13) 0.2500 0.01136(19) Uani 1 2 d S . . O2 O 0.41210(13) 0.53342(14) 0.2500 0.0133(2) Uani 1 2 d S . . O3 O 0.08472(10) 0.34168(11) 0.07039(12) 0.01554(17) Uani 1 1 d . . . F F 0.0000 0.0000 0.2500 0.0100(11) Uiso 0.68(3) 6 d SP . . O(H) O 0.0000 0.0000 0.195(3) 0.011(3) Uiso 0.19(2) 3 d SP . . loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_23 _atom_site_aniso_U_13 _atom_site_aniso_U_12 Ca1 0.01221(11) 0.01221(11) 0.00704(15) 0.000 0.000 0.00610(5) Ca2 0.01024(14) 0.01099(14) 0.00844(14) 0.000 0.000 0.00607(10) Eu2 0.01024(14) 0.01099(14) 0.00844(14) 0.000 0.000 0.00607(10) P 0.00634(14) 0.00579(15) 0.00664(15) 0.000 0.000 0.00245(11) O1 0.0110(4) 0.0068(4) 0.0123(5) 0.000 0.000 0.0015(3) O2 0.0077(4) 0.0106(4) 0.0204(5) 0.000 0.000 0.0037(4) O3 0.0146(3) 0.0260(4) 0.0103(3) -0.0075(3) -0.0028(3) 0.0134(3) _geom_special_details ; All esds (except the esd in the dihedral angle between two l.s. planes) are estimated using the full covariance matrix. The cell esds are taken into account individually in the estimation of esds in distances, angles and torsion angles; correlations between esds in cell parameters are only used when they are defined by crystal symmetry. An approximate (isotropic) treatment of cell esds is used for estimating esds involving l.s. planes. ; loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance _geom_bond_site_symmetry_2 _geom_bond_publ_flag Ca1 O1 2.4001(8) 2_655 ? Ca1 O1 2.4001(8) . ? Ca1 O1 2.4002(8) 3_665 ? Ca1 O2 2.4549(8) 9_655 ? Ca1 O2 2.4549(8) 8 ? Ca1 O2 2.4549(8) 7_665 ? Ca1 O3 2.8069(9) 9_655 ? Ca1 O3 2.8069(9) 7_665 ? Ca1 O3 2.8069(9) 8 ? Ca1 P 3.2085(4) 7_655 ? Ca1 P 3.2085(4) 8_665 ? Ca1 P 3.2085(4) 9 ? Ca2 F 2.3060(3) . ? Ca2 O(H) 2.337(3) . ? Ca2 O(H) 2.337(3) 10_556 ? Ca2 O3 2.3495(8) 5 ? Ca2 O3 2.3495(8) 8 ? Ca2 O2 2.3754(12) . ? Ca2 O3 2.4967(8) 10_556 ? Ca2 O3 2.4967(8) . ? Ca2 O1 2.6915(12) . ? Ca2 P 3.0719(5) 2 ? Ca2 P 3.2582(5) . ? Ca2 P 3.4952(5) 3_665 ? P O3 1.5355(8) 3 ? P O3 1.5355(8) 12_556 ? P O1 1.5366(11) . ? P O2 1.5426(11) 2_655 ? P Eu2 3.0718(5) 3 ? P Ca2 3.0718(5) 3 ? P Ca1 3.2085(4) 7_655 ? P Ca1 3.2085(4) 4_655 ? P Eu2 3.4952(5) 2_655 ? P Ca2 3.4952(5) 2_655 ? O1 Ca1 2.4001(8) 10_556 ? O2 P 1.5426(11) 3_665 ? O2 Ca1 2.4548(8) 4_665 ? O2 Ca1 2.4548(8) 7_665 ? O3 P 1.5355(8) 2 ? O3 Eu2 2.3495(8) 9 ? O3 Ca2 2.3495(8) 9 ? O3 Ca1 2.8069(9) 7_665 ? F O(H) 0.38(2) 10_556 ? F Eu2 2.3060(3) 3 ? F Ca2 2.3060(3) 3 ? F Eu2 2.3060(3) 2 ? F Ca2 2.3060(3) 2 ? O(H) O(H) 0.76(4) 10_556 ? O(H) Eu2 2.337(3) 3 ? O(H) Ca2 2.337(3) 3 ? O(H) Eu2 2.337(3) 2 ? O(H) Ca2 2.337(3) 2 ? loop_ _geom_angle_atom_site_label_1 _geom_angle_atom_site_label_2 _geom_angle_atom_site_label_3 _geom_angle _geom_angle_site_symmetry_1 _geom_angle_site_symmetry_3 _geom_angle_publ_flag O1 Ca1 O1 74.63(3) 2_655 . ? O1 Ca1 O1 74.63(3) 2_655 3_665 ? O1 Ca1 O1 74.63(3) . 3_665 ? O1 Ca1 O2 92.71(3) 2_655 9_655 ? O1 Ca1 O2 154.46(4) . 9_655 ? O1 Ca1 O2 124.02(3) 3_665 9_655 ? O1 Ca1 O2 124.02(3) 2_655 8 ? O1 Ca1 O2 92.71(3) . 8 ? O1 Ca1 O2 154.46(4) 3_665 8 ? O2 Ca1 O2 75.87(3) 9_655 8 ? O1 Ca1 O2 154.46(4) 2_655 7_665 ? O1 Ca1 O2 124.02(3) . 7_665 ? O1 Ca1 O2 92.70(3) 3_665 7_665 ? O2 Ca1 O2 75.87(3) 9_655 7_665 ? O2 Ca1 O2 75.87(3) 8 7_665 ? O1 Ca1 O3 68.83(3) 2_655 9_655 ? O1 Ca1 O3 86.88(3) . 9_655 ? O1 Ca1 O3 142.30(3) 3_665 9_655 ? O2 Ca1 O3 67.74(3) 9_655 9_655 ? O2 Ca1 O3 55.99(3) 8 9_655 ? O2 Ca1 O3 124.58(3) 7_665 9_655 ? O1 Ca1 O3 86.88(3) 2_655 7_665 ? O1 Ca1 O3 142.30(3) . 7_665 ? O1 Ca1 O3 68.83(3) 3_665 7_665 ? O2 Ca1 O3 55.99(3) 9_655 7_665 ? O2 Ca1 O3 124.58(3) 8 7_665 ? O2 Ca1 O3 67.74(3) 7_665 7_665 ? O3 Ca1 O3 116.993(11) 9_655 7_665 ? O1 Ca1 O3 142.30(3) 2_655 8 ? O1 Ca1 O3 68.83(3) . 8 ? O1 Ca1 O3 86.88(3) 3_665 8 ? O2 Ca1 O3 124.58(3) 9_655 8 ? O2 Ca1 O3 67.74(3) 8 8 ? O2 Ca1 O3 55.99(3) 7_665 8 ? O3 Ca1 O3 116.993(11) 9_655 8 ? O3 Ca1 O3 116.993(11) 7_665 8 ? O1 Ca1 P 97.38(3) 2_655 7_655 ? O1 Ca1 P 93.05(2) . 7_655 ? O1 Ca1 P 166.63(2) 3_665 7_655 ? O2 Ca1 P 66.20(3) 9_655 7_655 ? O2 Ca1 P 27.75(3) 8 7_655 ? O2 Ca1 P 98.62(2) 7_665 7_655 ? O3 Ca1 P 28.591(17) 9_655 7_655 ? O3 Ca1 P 122.180(19) 7_665 7_655 ? O3 Ca1 P 93.556(18) 8 7_655 ? O1 Ca1 P 93.05(2) 2_655 8_665 ? O1 Ca1 P 166.63(2) . 8_665 ? O1 Ca1 P 97.38(3) 3_665 8_665 ? O2 Ca1 P 27.75(3) 9_655 8_665 ? O2 Ca1 P 98.62(2) 8 8_665 ? O2 Ca1 P 66.20(3) 7_665 8_665 ? O3 Ca1 P 93.556(18) 9_655 8_665 ? O3 Ca1 P 28.591(17) 7_665 8_665 ? O3 Ca1 P 122.180(19) 8 8_665 ? P Ca1 P 93.693(9) 7_655 8_665 ? O1 Ca1 P 166.63(2) 2_655 9 ? O1 Ca1 P 97.38(3) . 9 ? O1 Ca1 P 93.05(2) 3_665 9 ? O2 Ca1 P 98.62(2) 9_655 9 ? O2 Ca1 P 66.20(3) 8 9 ? O2 Ca1 P 27.75(3) 7_665 9 ? O3 Ca1 P 122.180(19) 9_655 9 ? O3 Ca1 P 93.556(18) 7_665 9 ? O3 Ca1 P 28.591(17) 8 9 ? P Ca1 P 93.693(9) 7_655 9 ? P Ca1 P 93.693(9) 8_665 9 ? F Ca2 O(H) 9.3(5) . . ? F Ca2 O(H) 9.3(5) . 10_556 ? O(H) Ca2 O(H) 18.6(10) . 10_556 ? F Ca2 O3 102.80(2) . 5 ? O(H) Ca2 O3 111.8(5) . 5 ? O(H) Ca2 O3 93.8(5) 10_556 5 ? F Ca2 O3 102.80(2) . 8 ? O(H) Ca2 O3 93.8(5) . 8 ? O(H) Ca2 O3 111.8(5) 10_556 8 ? O3 Ca2 O3 139.78(5) 5 8 ? F Ca2 O2 152.46(3) . . ? O(H) Ca2 O2 151.05(15) . . ? O(H) Ca2 O2 151.05(15) 10_556 . ? O3 Ca2 O2 85.70(2) 5 . ? O3 Ca2 O2 85.70(2) 8 . ? F Ca2 O3 81.76(2) . 10_556 ? O(H) Ca2 O3 86.5(3) . 10_556 ? O(H) Ca2 O3 77.2(2) 10_556 10_556 ? O3 Ca2 O3 77.985(18) 5 10_556 ? O3 Ca2 O3 136.23(3) 8 10_556 ? O2 Ca2 O3 74.39(3) . 10_556 ? F Ca2 O3 81.76(2) . . ? O(H) Ca2 O3 77.2(2) . . ? O(H) Ca2 O3 86.5(3) 10_556 . ? O3 Ca2 O3 136.23(3) 5 . ? O3 Ca2 O3 77.985(18) 8 . ? O2 Ca2 O3 74.39(3) . . ? O3 Ca2 O3 59.39(4) 10_556 . ? F Ca2 O1 106.74(2) . . ? O(H) Ca2 O1 106.52(3) . . ? O(H) Ca2 O1 106.52(3) 10_556 . ? O3 Ca2 O1 71.60(2) 5 . ? O3 Ca2 O1 71.60(2) 8 . ? O2 Ca2 O1 100.79(4) . . ? O3 Ca2 O1 149.51(2) 10_556 . ? O3 Ca2 O1 149.51(2) . . ? F Ca2 P 82.984(10) . 2 ? O(H) Ca2 P 83.077(14) . 2 ? O(H) Ca2 P 83.077(14) 10_556 2 ? O3 Ca2 P 106.74(2) 5 2 ? O3 Ca2 P 106.74(2) 8 2 ? O2 Ca2 P 69.48(3) . 2 ? O3 Ca2 P 29.789(18) 10_556 2 ? O3 Ca2 P 29.788(18) . 2 ? O1 Ca2 P 170.27(3) . 2 ? F Ca2 P 78.833(10) . . ? O(H) Ca2 P 78.982(19) . . ? O(H) Ca2 P 78.982(19) 10_556 . ? O3 Ca2 P 77.58(2) 5 . ? O3 Ca2 P 77.58(2) 8 . ? O2 Ca2 P 128.70(3) . . ? O3 Ca2 P 144.37(2) 10_556 . ? O3 Ca2 P 144.37(2) . . ? O1 Ca2 P 27.91(2) . . ? P Ca2 P 161.817(12) 2 . ? F Ca2 P 173.682(13) . 3_665 ? O(H) Ca2 P 168.8(4) . 3_665 ? O(H) Ca2 P 168.8(4) 10_556 3_665 ? O3 Ca2 P 78.97(2) 5 3_665 ? O3 Ca2 P 78.97(2) 8 3_665 ? O2 Ca2 P 21.22(3) . 3_665 ? O3 Ca2 P 92.76(2) 10_556 3_665 ? O3 Ca2 P 92.76(2) . 3_665 ? O1 Ca2 P 79.58(2) . 3_665 ? P Ca2 P 90.698(13) 2 3_665 ? P Ca2 P 107.485(13) . 3_665 ? O3 P O3 107.32(7) 3 12_556 ? O3 P O1 111.07(4) 3 . ? O3 P O1 111.07(4) 12_556 . ? O3 P O2 107.95(4) 3 2_655 ? O3 P O2 107.95(4) 12_556 2_655 ? O1 P O2 111.31(6) . 2_655 ? O3 P Eu2 53.88(3) 3 3 ? O3 P Eu2 53.88(3) 12_556 3 ? O1 P Eu2 133.26(5) . 3 ? O2 P Eu2 115.43(5) 2_655 3 ? O3 P Ca2 53.88(3) 3 3 ? O3 P Ca2 53.88(3) 12_556 3 ? O1 P Ca2 133.26(5) . 3 ? O2 P Ca2 115.43(5) 2_655 3 ? Eu2 P Ca2 0.000(12) 3 3 ? O3 P Ca1 61.02(4) 3 7_655 ? O3 P Ca1 112.56(3) 12_556 7_655 ? O1 P Ca1 135.88(3) . 7_655 ? O2 P Ca1 47.81(3) 2_655 7_655 ? Eu2 P Ca1 80.160(9) 3 7_655 ? Ca2 P Ca1 80.160(9) 3 7_655 ? O3 P Ca1 112.56(3) 3 4_655 ? O3 P Ca1 61.02(4) 12_556 4_655 ? O1 P Ca1 135.88(3) . 4_655 ? O2 P Ca1 47.81(3) 2_655 4_655 ? Eu2 P Ca1 80.160(9) 3 4_655 ? Ca2 P Ca1 80.160(9) 3 4_655 ? Ca1 P Ca1 65.214(13) 7_655 4_655 ? O3 P Ca2 79.60(4) 3 . ? O3 P Ca2 79.60(4) 12_556 . ? O1 P Ca2 55.07(4) . . ? O2 P Ca2 166.39(5) 2_655 . ? Eu2 P Ca2 78.183(12) 3 . ? Ca2 P Ca2 78.183(12) 3 . ? Ca1 P Ca2 140.570(8) 7_655 . ? Ca1 P Ca2 140.570(8) 4_655 . ? O3 P Eu2 122.55(4) 3 2_655 ? O3 P Eu2 122.55(4) 12_556 2_655 ? O1 P Eu2 77.44(4) . 2_655 ? O2 P Eu2 33.87(4) 2_655 2_655 ? Eu2 P Eu2 149.301(13) 3 2_655 ? Ca2 P Eu2 149.301(13) 3 2_655 ? Ca1 P Eu2 74.087(8) 7_655 2_655 ? Ca1 P Eu2 74.087(8) 4_655 2_655 ? Ca2 P Eu2 132.515(13) . 2_655 ? O3 P Ca2 122.55(4) 3 2_655 ? O3 P Ca2 122.55(4) 12_556 2_655 ? O1 P Ca2 77.44(4) . 2_655 ? O2 P Ca2 33.87(4) 2_655 2_655 ? Eu2 P Ca2 149.301(13) 3 2_655 ? Ca2 P Ca2 149.301(13) 3 2_655 ? Ca1 P Ca2 74.087(8) 7_655 2_655 ? Ca1 P Ca2 74.087(8) 4_655 2_655 ? Ca2 P Ca2 132.515(13) . 2_655 ? Eu2 P Ca2 0.000(9) 2_655 2_655 ? P O1 Ca1 129.67(3) . . ? P O1 Ca1 129.67(3) . 10_556 ? Ca1 O1 Ca1 91.15(4) . 10_556 ? P O1 Ca2 97.02(5) . . ? Ca1 O1 Ca2 101.95(3) . . ? Ca1 O1 Ca2 101.95(3) 10_556 . ? P O2 Ca2 124.91(6) 3_665 . ? P O2 Ca1 104.44(4) 3_665 4_665 ? Ca2 O2 Ca1 113.73(3) . 4_665 ? P O2 Ca1 104.44(4) 3_665 7_665 ? Ca2 O2 Ca1 113.73(3) . 7_665 ? Ca1 O2 Ca1 89.55(4) 4_665 7_665 ? P O3 Eu2 142.03(5) 2 9 ? P O3 Ca2 142.03(5) 2 9 ? Eu2 O3 Ca2 0.000(15) 9 9 ? P O3 Ca2 96.33(4) 2 . ? Eu2 O3 Ca2 117.51(3) 9 . ? Ca2 O3 Ca2 117.51(3) 9 . ? P O3 Ca1 90.39(4) 2 7_665 ? Eu2 O3 Ca1 99.96(3) 9 7_665 ? Ca2 O3 Ca1 99.96(3) 9 7_665 ? Ca2 O3 Ca1 99.23(3) . 7_665 ? O(H) F Eu2 90.000(3) 10_556 3 ? O(H) F Ca2 90.000(3) 10_556 3 ? Eu2 F Ca2 0.000(14) 3 3 ? O(H) F Eu2 90.000(3) 10_556 2 ? Eu2 F Eu2 120.0 3 2 ? Ca2 F Eu2 120.0 3 2 ? O(H) F Ca2 90.000(3) 10_556 2 ? Eu2 F Ca2 120.0 3 2 ? Ca2 F Ca2 120.0 3 2 ? Eu2 F Ca2 0.0 2 2 ? O(H) F Ca2 90.000(5) 10_556 . ? Eu2 F Ca2 120.0 3 . ? Ca2 F Ca2 120.0 3 . ? Eu2 F Ca2 120.0 2 . ? Ca2 F Ca2 120.0 2 . ? O(H) O(H) Eu2 80.7(5) 10_556 3 ? O(H) O(H) Ca2 80.7(5) 10_556 3 ? Eu2 O(H) Ca2 0.000(13) 3 3 ? O(H) O(H) Eu2 80.7(5) 10_556 2 ? Eu2 O(H) Eu2 117.4(3) 3 2 ? Ca2 O(H) Eu2 117.4(3) 3 2 ? O(H) O(H) Ca2 80.7(5) 10_556 2 ? Eu2 O(H) Ca2 117.4(3) 3 2 ? Ca2 O(H) Ca2 117.4(3) 3 2 ? Eu2 O(H) Ca2 0.000(3) 2 2 ? O(H) O(H) Ca2 80.7(5) 10_556 . ? Eu2 O(H) Ca2 117.4(3) 3 . ? Ca2 O(H) Ca2 117.4(3) 3 . ? Eu2 O(H) Ca2 117.4(3) 2 . ? Ca2 O(H) Ca2 117.4(3) 2 . ? _diffrn_measured_fraction_theta_max 0.985 _diffrn_reflns_theta_full 33.00 _diffrn_measured_fraction_theta_full 0.985 _refine_diff_density_max 0.436 _refine_diff_density_min -0.293 _refine_diff_density_rms 0.070