data_global
_amcsd_formula_title 'B5 Ca3 La3 O15'
loop_
_publ_author_name
'Zhang Y'
'Liang J'
'Chen X'
'He M'
'Xu T'
_journal_name_full 'Journal of Alloys and Compounds'
_journal_volume 327 
_journal_year 2001
_journal_page_first 96
_journal_page_last 99
_publ_section_title
;
 A structural study of Ca3La3(BO3)5
 _cod_database_code 1100055
;
_database_code_amcsd 0018238
_chemical_formula_sum 'B5 Ca3 La3 O15'
_cell_length_a 10.5319
_cell_length_b 10.5319
_cell_length_c 6.4077
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_volume 615.526
_exptl_crystal_density_diffrn      4.484
_symmetry_space_group_name_H-M 'P 63 m c'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-x,-x+y,1/2+z'
  'x-y,x,1/2+z'
  '-y,-x,z'
  '-y,x-y,z'
  'x-y,-y,1/2+z'
  '-x,-y,1/2+z'
  'x,x-y,z'
  '-x+y,-x,z'
  'y,x,1/2+z'
  'y,-x+y,1/2+z'
  '-x+y,y,z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
B1   0.00000   0.00000   0.75200
B2   0.33333   0.66667   0.39330
B3   0.80330  -0.80330   0.46140
Ca1   0.52710  -0.52710   0.23660
La1   0.84400  -0.84400  -0.08260
O1   0.37380   0.06680   0.55160
O2   0.92690  -0.92690   0.25660
O3   0.40870  -0.40870   0.39930
O4   0.77500  -0.77500  -0.26910