data_global _amcsd_formula_title 'B2 Ca O10 U2' loop_ _publ_author_name 'Gasperin M' _journal_name_full 'Acta Crystallographica, Section C' _journal_volume 43 _journal_year 1987 _journal_page_first 1247 _journal_page_last 1250 _publ_section_title ; Synthese et structure du borouranate de calcium: Ca B2 U2 O10. _cod_database_code 1001347 ; _database_code_amcsd 0010039 _chemical_formula_sum 'U2 Ca B2 O10' _cell_length_a 16.512 _cell_length_b 8.169 _cell_length_c 6.582 _cell_angle_alpha 90 _cell_angle_beta 96.97 _cell_angle_gamma 90 _cell_volume 881.262 _exptl_crystal_density_diffrn 5.259 _symmetry_space_group_name_H-M 'C 1 2 1' loop_ _space_group_symop_operation_xyz 'x,y,z' '1/2+x,1/2+y,z' '-x,y,-z' '1/2-x,1/2+y,-z' loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy U1 0.00000 0.00000 0.00000 1.00000 U2 0.00000 0.50010 0.00000 1.00000 U3 0.12015 0.00050 0.55893 1.00000 Ca1 0.33700 -0.00410 0.41720 1.00000 B1 0.19660 -0.00780 0.07670 1.00000 B2 0.30320 0.00040 0.83860 1.00000 O1 0.18910 -0.00440 0.27880 1.00000 O2 0.45030 -0.01290 0.22900 1.00000 O3 0.27780 0.00190 0.03160 1.00000 O4 0.86730 0.00670 0.07250 1.00000 O5 0.38130 0.01660 0.80720 1.00000 O6 0.60760 0.27680 0.54210 1.00000 O7 0.00950 0.02930 0.31090 1.00000 O8 0.25070 0.03990 0.67470 1.00000 O9 0.13820 0.21700 0.58180 1.00000 O10 0.01080 0.22670 0.05530 0.50000 O11 -0.01070 0.76940 -0.03720 0.50000