data_global
_amcsd_formula_title 'Co2P2O7'
loop_
_publ_author_name
'Bali B E'
'Bolte M'
_journal_name_full 'Acta Crystallographica, Section E'
_journal_volume 58 
_journal_year 2002
_journal_page_first i32
_journal_page_last i33
_publ_section_title
;
 Rerefinement of cobalt diphosphate against new intensity data
;
_database_code_amcsd 0010375
_chemical_formula_sum 'Co2 P2 O7'
_cell_length_a 7.0022
_cell_length_b 8.3634
_cell_length_c 9.0114
_cell_angle_alpha 90
_cell_angle_beta 113.600
_cell_angle_gamma 90
_cell_volume 483.590
_exptl_crystal_density_diffrn      4.008
_symmetry_space_group_name_H-M 'P 1 21/c 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'x,1/2-y,1/2+z'
  '-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
Co1   0.23247   0.92882   0.10884   0.00799
Co2   0.69933   0.44157   0.82475   0.00860
P1   0.94042   0.76797   0.75824   0.00746
P2   0.53170   0.77429   0.46771   0.00713
O1   0.74908   0.82989   0.60005   0.01100
O2   0.37848   0.76488   0.54938   0.00960
O3   0.11902   0.75915   0.70267   0.00930
O4   0.97662   0.90145   0.88165   0.00950
O5   0.88706   0.61064   0.81112   0.01260
O6   0.48086   0.90934   0.34431   0.00920
O7   0.55344   0.61280   0.39749   0.00970
loop_
_atom_site_aniso_label
_atom_site_aniso_U_11
_atom_site_aniso_U_22
_atom_site_aniso_U_33
_atom_site_aniso_U_12
_atom_site_aniso_U_13
_atom_site_aniso_U_23
Co1 0.00769 0.00809 0.00812 0.00033 0.00307 0.00007
Co2 0.00846 0.00823 0.00975 -0.00018 0.00431 0.00030
P1 0.00673 0.00807 0.00767 -0.00038 0.00298 -0.00058
P2 0.00668 0.00790 0.00660 -0.00011 0.00244 -0.00014
O1 0.00800 0.01280 0.00920 0.00030 0.00040 -0.00070
O2 0.00980 0.01020 0.01020 -0.00130 0.00540 -0.00080
O3 0.00830 0.01010 0.01020 -0.00030 0.00440 -0.00010
O4 0.00970 0.01030 0.00830 0.00100 0.00340 -0.00160
O5 0.01370 0.00990 0.01660 -0.00180 0.00850 -0.00040
O6 0.00960 0.00910 0.00830 -0.00070 0.00310 0.00130
O7 0.01000 0.00900 0.00950 0.00080 0.00320 -0.00120