data_global
_chemical_name_mineral 'Lucabindiite'
loop_
_publ_author_name
'Garavelli A'
'Mitolo D'
'Pinto D'
'Vurro F'
_journal_name_full 'American Mineralogist'
_journal_volume 98 
_journal_year 2013
_journal_page_first 470
_journal_page_last 477
_publ_section_title
;
 Lucabindiite, (K,NH4)As4O6(Cl,Br), a new fumarole mineral from
 the "La Fossa" crater at Vulcano, Aeolian Islands, Italy
;
_database_code_amcsd 0019797
_chemical_compound_source 'La Fossa crater at Vulcano, Aeolian Islands, Italy'
_chemical_formula_sum 'K.52 N.48 H1.92 As4 O6 (Cl.5 Br.3 F.2)'
_cell_length_a 5.2386
_cell_length_b 5.2386
_cell_length_c 9.014
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 120
_cell_volume 214.229
_exptl_crystal_density_diffrn      3.644
_symmetry_space_group_name_H-M 'P 6/m m m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-x,-x+y,z'
  'x,x-y,-z'
  '-x+y,-x,-z'
  'x-y,x,z'
  '-y,-x,z'
  'y,x,-z'
  'y,-x+y,-z'
  '-y,x-y,z'
  'x-y,-y,z'
  '-x+y,y,-z'
  'x,y,-z'
  '-x,-y,z'
  'x,x-y,z'
  '-x,-x+y,-z'
  'x-y,x,-z'
  '-x+y,-x,z'
  'y,x,z'
  '-y,-x,-z'
  '-y,x-y,-z'
  'y,-x+y,z'
  '-x+y,y,z'
  'x-y,-y,-z'
  '-x,-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
KM   0.00000   0.00000   0.50000   0.52000   0.04300
NM   0.00000   0.00000   0.50000   0.48000   0.04300
H1M   0.00000   0.00000   0.50000   0.48000   0.04300
H2M   0.00000   0.00000   0.50000   0.48000   0.04300
H3M   0.00000   0.00000   0.50000   0.48000   0.04300
H4M   0.00000   0.00000   0.50000   0.48000   0.04300
As   0.33333   0.66667   0.79690   1.00000   0.01450
O   0.50000   0.00000   0.68940   1.00000   0.01900
ClX   0.00000   0.00000   0.00000   0.50000   0.03700
BrX   0.00000   0.00000   0.00000   0.30000   0.03700
FX   0.00000   0.00000   0.00000   0.20000   0.03700
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
KM 0.04100 0.04100 0.04700 0.02000 0.00000 0.00000
NM 0.04100 0.04100 0.04700 0.02000 0.00000 0.00000
H1M 0.04100 0.04100 0.04700 0.02000 0.00000 0.00000
H2M 0.04100 0.04100 0.04700 0.02000 0.00000 0.00000
H3M 0.04100 0.04100 0.04700 0.02000 0.00000 0.00000
H4M 0.04100 0.04100 0.04700 0.02000 0.00000 0.00000
As 0.00780 0.00780 0.02780 0.00390 0.00000 0.00000
O 0.01650 0.00700 0.03100 0.00300 0.00000 0.00000
ClX 0.02060 0.02060 0.06900 0.01030 0.00000 0.00000
BrX 0.02060 0.02060 0.06900 0.01030 0.00000 0.00000
FX 0.02060 0.02060 0.06900 0.01030 0.00000 0.00000