data_global
_chemical_name_mineral 'Ognitite'
loop_
_publ_author_name
'Barkov A Y'
'Bindi L'
'Tamura N'
'Shvedov G I'
'Winkler B'
'Stan C V'
'Morgenroth W'
'Martin R F'
'Zaccarini F'
'Stanley C J'
_journal_name_full 'Mineralogical Magazine'
_journal_volume 83 
_journal_year 2019
_journal_page_first 695
_journal_page_last 703
_publ_section_title
;
 Ognitite, NiBiTe, a new mineral species, and Co-rich maucherite from
 the Ognit ultramafic complex, Eastern Sayans, Russia
;
_database_code_amcsd 0020948
_chemical_compound_source 'Ognit ultramafic complex, Eastern Sayans, Russia'
_chemical_formula_sum 'Ni Bi.98 Te'
_cell_length_a 3.9280
_cell_length_b 3.9280
_cell_length_c 5.3850
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_volume 71.955
_exptl_crystal_density_diffrn      9.025
_symmetry_space_group_name_H-M 'P 3 m 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-y,-x,z'
  '-y,x-y,z'
  'x,x-y,z'
  '-x+y,-x,z'
  '-x+y,y,z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
_atom_site_U_iso_or_equiv
Ni   0.00000   0.00000   0.00020   1.00000   0.02830
Bi   0.33333   0.66667   0.72947   0.98000   0.04990
Te   0.66667   0.33333   0.22670   1.00000   0.02950
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
Ni 0.02670 0.02670 0.03100 0.01340 0.00000 0.00000
Bi 0.04360 0.04360 0.06250 0.02180 0.00000 0.00000
Te 0.03310 0.03310 0.02240 0.01660 0.00000 0.00000