data_global
_chemical_name_mineral 'Ziminaite'
loop_
_publ_author_name
'Robertson B'
'Kostiner E'
_journal_name_full 'Journal of Solid State Chemistry'
_journal_volume 4 
_journal_year 1972
_journal_page_first 29
_journal_page_last 37
_publ_section_title
;
 Crystal structure and Moessbauer effect investigation of FeVO4
;
_database_code_amcsd 0020265
_chemical_compound_source 'Synthetic'
_chemical_formula_sum 'Fe V O4'
_cell_length_a 6.719
_cell_length_b 8.060
_cell_length_c 9.254
_cell_angle_alpha 96.65
_cell_angle_beta 106.57
_cell_angle_gamma 101.60
_cell_volume 462.459
_exptl_crystal_density_diffrn      3.679
_symmetry_space_group_name_H-M 'P -1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
Fe1   0.75204   0.69423   0.40881
Fe2   0.46597   0.88944   0.21160
Fe3   0.96885   0.30568   0.01195
V1   0.00496   0.99694   0.25674
V2   0.19955   0.60155   0.34332
V3   0.52063   0.29906   0.12734
O1   0.64510   0.48440   0.25140
O2   0.25480   0.43750   0.42600
O3   0.05260   0.69900   0.42800
O4   0.15860   0.09540   0.42910
O5   0.45300   0.73880   0.36110
O6   0.76110   0.86700   0.26490
O7   0.52730   0.12770   0.21970
O8   0.15140   0.87200   0.17720
O9   0.35690   0.73080   0.01930
O10   0.26410   0.29600   0.03850
O11   0.94950   0.14520   0.15240
O12   0.05370   0.52730   0.14720
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
Fe1 0.00540 0.00490 0.00580 0.00060 0.00220 0.00050
Fe2 0.00470 0.00570 0.00690 0.00060 0.00230 0.00160
Fe3 0.00500 0.00460 0.00560 0.00030 0.00180 -0.00040
V1 0.00410 0.00380 0.00460 0.00040 0.00270 0.00010
V2 0.00400 0.00510 0.00450 0.00010 0.00230 0.00040
V3 0.00430 0.00380 0.00640 0.00010 0.00290 -0.00100
O1 0.01500 0.00800 0.01300 -0.00200 0.00400 -0.00300
O2 0.01400 0.01100 0.01100 0.00300 0.00400 0.00400
O3 0.00800 0.01400 0.01200 0.00200 0.00600 -0.00300
O4 0.01200 0.00900 0.00900 0.00000 0.00300 -0.00200
O5 0.00600 0.01100 0.01000 0.00100 0.00400 0.00500
O6 0.00500 0.00900 0.00900 0.00000 0.00200 0.00400
O7 0.01700 0.00700 0.02000 0.00300 0.00800 0.00500
O8 0.00700 0.01000 0.01000 0.00200 0.00400 -0.00300
O9 0.00700 0.01200 0.00900 0.00100 0.00300 -0.00100
O10 0.00600 0.02200 0.01400 0.00500 0.00300 0.00100
O11 0.01300 0.01500 0.01700 0.00500 0.00700 0.00900
O12 0.01000 0.00800 0.00600 0.00000 0.00200 0.00000