data_global
_chemical_name_mineral 'Uralolite'
loop_
_publ_author_name
'Mereiter K'
'Niedermayr G'
'Walter F'
_journal_name_full 'European Journal of Mineralogy'
_journal_volume 6 
_journal_year 1994
_journal_page_first 887
_journal_page_last 896
_publ_section_title
;
 Uralolite, Ca2Be4(PO4)3(OH)3*5H2O: new data and crystal structure
;
_database_code_amcsd 0006579
_chemical_formula_sum 'Ca2 Be4 P3 O20 H13'
_cell_length_a 6.550
_cell_length_b 16.005
_cell_length_c 15.969
_cell_angle_alpha 90
_cell_angle_beta 101.64
_cell_angle_gamma 90
_cell_volume 1639.646
_exptl_crystal_density_diffrn      2.197
_symmetry_space_group_name_H-M 'P 1 21/n 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2-y,1/2+z'
  '1/2-x,1/2+y,1/2-z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Ca1   0.87910   0.08290   0.06760   0.01203
Ca2   0.11540   0.08300   0.43780   0.01406
Be1   0.24080   0.26230   0.12680   0.01013
Be2   0.59040   0.16640   0.17660   0.01013
Be3   0.41630   0.16280   0.33150   0.01267
Be4   0.76780   0.26470   0.38550   0.01267
P1   0.31280   0.11520   0.03200   0.00963
P2   0.69040   0.12350   0.48360   0.01001
P3   0.00620   0.21840   0.25700   0.00975
O1   0.17780   0.17140   0.07850   0.01267
O2   0.53510   0.11200   0.08670   0.01267
O3   0.31830   0.14910  -0.05720   0.01393
O4   0.21030   0.03020   0.02470   0.01520
O5   0.83030   0.18090   0.44000   0.01140
O6   0.47730   0.11330   0.42270   0.01267
O7   0.65240   0.16120   0.56670   0.01646
O8   0.80730   0.04210   0.49930   0.01520
O9   0.12740   0.27470   0.20650   0.01393
O10  -0.15310   0.16470   0.19580   0.01393
O11   0.16050   0.16050   0.31490   0.01267
O12  -0.09950   0.27390   0.31240   0.01267
O-H1   0.49210   0.25880   0.16210   0.01267
O-H2   0.51420   0.25750   0.34350   0.01393
O-H3   0.50380   0.11870   0.25370   0.01520
Wat1   0.77270   0.17170  -0.05070   0.03293
Wat2   0.94040  -0.03330   0.16840   0.03166
Wat3   0.24140   0.12990   0.58380   0.02153
Wat4  -0.14630   0.01220   0.32540   0.03420
Wat5   0.12410   0.44490   0.29000   0.07219