data_global
_chemical_name_mineral 'Innelite'
loop_
_publ_author_name
'Sokolova E'
'Camara F'
'Hawthorne F C'
_journal_name_full 'Mineralogical Magazine'
_journal_volume 75 
_journal_year 2011
_journal_page_first 2495
_journal_page_last 2518
_publ_section_title
;
 From structure topology to chemical composition. XI. Titanium silicates:
 crystal structures of innelite-1T and innelite-2M from the Inagli massif,
 Yakutia, Russia, and the crystal chemistry of innelite
 Note: this is the polytype innelite-2M
;
_database_code_amcsd 0018496
_chemical_compound_source 'Inagli massif, Yakutia, Russia'
_chemical_formula_sum '(Ba3.92 Sr.08) Ti2.96 Nb.02 Al.02 Na2.16 Ca.1 Mn.38 Fe.17 Mg.15 Si4 S1.02 P.8 O26'
_cell_length_a 5.4206
_cell_length_b 7.125
_cell_length_c 29.314
_cell_angle_alpha 90
_cell_angle_beta 94.698
_cell_angle_gamma 90
_cell_volume 1128.355
_exptl_crystal_density_diffrn      4.012
_symmetry_space_group_name_H-M 'P 1 2/c 1'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  'x,-y,1/2+z'
  '-x,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_occupancy
_atom_site_U_iso_or_equiv
BaAP   0.78700   0.13514   0.09047   0.98000   0.02290
SrAP   0.78700   0.13514   0.09047   0.02000   0.02290
BaBP   0.27200   0.65559   0.05453   0.98000   0.01370
SrBP   0.27200   0.65559   0.05453   0.02000   0.01370
TiMH   0.81280   0.64700   0.14953   0.98000   0.00890
NbMH   0.81280   0.64700   0.14953   0.01000   0.00890
AlMH   0.81280   0.64700   0.14953   0.01000   0.00890
TiMO1   0.50000   0.15430   0.25000   1.00000   0.02590
NaMO2   0.50000   0.65650   0.25000   1.00000   0.01700
NaMO3   0.00000   0.90960   0.25000   0.81000   0.02600
CaMO3   0.00000   0.90960   0.25000   0.10000   0.02600
MnMO3   0.00000   0.90960   0.25000   0.07000   0.02600
NaMO4   0.00000   0.39450   0.25000   0.35000   0.01400
MnMO4   0.00000   0.39450   0.25000   0.31000   0.01400
FeMO4   0.00000   0.39450   0.25000   0.17000   0.01400
MgMO4   0.00000   0.39450   0.25000   0.15000   0.01400
Si1   0.31640   0.93640   0.15620   1.00000   0.00530
Si2   0.31460   0.36770   0.15437   1.00000   0.00980
ST   0.25570   0.20750   0.01132   0.51000   0.01650
PT   0.25570   0.20750   0.01132   0.40000   0.01650
O1   0.06700   0.83800   0.13550   1.00000   0.01300
O2   0.56300   0.83790   0.13490   1.00000   0.00900
O3   0.34300   0.94800   0.21180   1.00000   0.01200
O4   0.30400   0.15140   0.13380   1.00000   0.01100
O5   0.53900   0.46270   0.13200   1.00000   0.01200
O6   0.04700   0.45800   0.13260   1.00000   0.01200
O7   0.33400   0.36640   0.20950   1.00000   0.01100
O8   0.84500   0.63600   0.20760   1.00000   0.02100
O9   0.78900   0.16800   0.21360   1.00000   0.03800
O10   0.27100   0.02500   0.03420   1.00000   0.04900
O11   0.04100   0.31500   0.02640   1.00000   0.02300
O12   0.48600   0.31400   0.02600   1.00000   0.02000
O13   0.76300   0.79400   0.04020   1.00000   0.03100