data_global _chemical_name_mineral 'Kazanskyite' loop_ _publ_author_name 'Camara F' 'Sokolova E' 'Hawthorne F C' _journal_name_full 'Mineralogical Magazine' _journal_volume 76 _journal_year 2012 _journal_page_first 473 _journal_page_last 492 _publ_section_title ; Kazanskyite, BaTiNbNa3Ti(Si2O7)2O2(OH)2(H2O)4, a Group-III Ti-disilicate mineral from the Khibiny alkaline massif, Kola Peninsula, Russia: description and crystal structure ; _database_code_amcsd 0018995 _chemical_compound_source 'Khibiny alkaline massif, Kola Peninsula, Russia' _chemical_formula_sum 'Ti2.09 Mn.57 Na2.55 Ca.14 Fe.03 Al.02 Nb.63 Si4 Ba.7 Sr.28 K.21 O21.42 F.6 H9.44' _cell_length_a 5.4260 _cell_length_b 7.135 _cell_length_c 25.514 _cell_angle_alpha 98.172 _cell_angle_beta 90.916 _cell_angle_gamma 89.964 _cell_volume 977.606 _exptl_crystal_density_diffrn 2.926 _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 _atom_site_occupancy _atom_site_U_iso_or_equiv TiMO(1) 0.39620 0.14320 0.30847 0.74000 0.02750 MnMO(1 0.39620 0.14320 0.30847 0.26000 0.02750 NaMO(2) 0.38110 0.63730 0.30400 1.00000 0.03250 NaMO(3) 0.88730 0.89540 0.30320 0.78000 0.01260 CaMO(3) 0.88730 0.89540 0.30320 0.11000 0.01260 MnMO(3) 0.88730 0.89540 0.30320 0.11000 0.01260 NaMO(4) 0.88600 0.38280 0.30420 0.77000 0.01150 MnMO(4) 0.88600 0.38280 0.30420 0.20000 0.01150 FeMO(4) 0.88600 0.38280 0.30420 0.03000 0.01150 TiMH(1) 0.74440 0.70590 0.41946 0.98000 0.01430 AlMH(1) 0.74440 0.70590 0.41946 0.02000 0.01430 NbMH(2) 0.01720 0.57590 0.18391 0.63000 0.01740 TiMH(2) 0.01720 0.57590 0.18391 0.37000 0.01740 Si(1) 0.24640 0.41640 0.41368 1.00000 0.01110 Si(2) 0.24250 -0.01590 0.41606 1.00000 0.01140 Si(3) 0.51250 0.87400 0.19727 1.00000 0.01120 Si(4) 0.52490 0.29610 0.19860 1.00000 0.02700 BaAP(1) 0.74633 0.23498 0.47349 0.56000 0.01090 SrAP(1) 0.74633 0.23498 0.47349 0.22000 0.01090 KAP(1) 0.74633 0.23498 0.47349 0.15000 0.01090 CaAP(1) 0.74633 0.23498 0.47349 0.03000 0.01090 BaAP(2) 0.01340 0.06540 0.13298 0.14000 0.03370 SrAP(2) 0.01340 0.06540 0.13298 0.06000 0.03370 KAP(2) 0.01340 0.06540 0.13298 0.06000 0.03370 O(1) 0.50900 0.91510 0.25920 1.00000 0.02200 O(2) 0.51720 0.07090 0.17300 1.00000 0.03110 O(3) 0.77200 0.37560 0.17700 1.00000 0.04800 O(4) 0.48220 0.53780 0.44030 1.00000 0.02000 O(5) 0.24630 0.21490 0.44070 1.00000 0.01400 O(6) 0.49660 0.91040 0.43900 1.00000 0.00900 O(7) -0.00100 0.90260 0.44230 1.00000 0.01700 O(8) 0.23700 0.36650 0.35150 1.00000 0.02100 O(9) 0.00300 0.52460 0.43640 1.00000 0.01200 O(10) 0.23700 0.95840 0.35200 1.00000 0.01500 O(11) 0.27940 0.75620 0.17390 1.00000 0.02300 O(12) 0.53800 0.32950 0.26450 1.00000 0.02200 O(13) 0.26600 0.37120 0.17530 1.00000 0.03200 O(14) 0.75450 0.76830 0.17520 1.00000 0.02300 OXOM(1) 0.74410 0.66330 0.35370 1.00000 0.02020 OXOM(2) 0.02410 0.61060 0.25620 1.00000 0.03300 O-HXOA(1) 0.67850 0.16400 0.35210 0.70000 0.02160 FXOA(1) 0.67850 0.16400 0.35210 0.30000 0.02160 O-HXOA(2) 0.08140 0.11460 0.26420 0.70000 0.02130 FXOA(2) 0.08140 0.11460 0.26420 0.30000 0.02130 WatXPM 0.00610 0.53100 0.09520 1.00000 0.05000 WatXPA 0.23500 0.19900 0.05630 0.26000 0.05000 WatW(1) 0.50700 0.59300 0.08090 0.71000 0.05000 WatW(2) 0.51100 0.16700 0.03700 0.46000 0.05000 WatW(3) 0.52300 0.41600 0.05460 0.34000 0.05000 WatW(4) 0.50200 0.89200 0.06440 0.29000 0.05000 WatW(5) 0.14500 0.44600 0.00010 0.25000 0.05000 WatW(6) -0.01300 0.88000 0.06440 0.40000 0.05000 WatW(7) 0.29800 -0.00200 -0.00110 0.31000 0.05000