data_global _chemical_name_mineral 'Olenite' loop_ _publ_author_name 'Ertl A' 'Schuster R' 'Hughes J M' 'Ludwig T' 'Meyer H-P' 'Finger F' 'Dyar M D' 'Ruschel K' 'Rossman G R' 'Klotzli U' 'Brandstatter F' 'Lengauer C L' 'Tillmanns E' _journal_name_full 'European Journal of Mineralogy' _journal_volume 24 _journal_year 2012 _journal_page_first 695 _journal_page_last 715 _publ_section_title ; Li-bearing tourmalines in Variscan granitic pegmatites from the Moldanubian nappes, Lower Austria Note: Sample MAG ; _database_code_amcsd 0019402 _chemical_compound_source 'Maigen, Moldanubian nappes, Lower Austria' _chemical_formula_sum 'Na.56 Ca.01 K.01 Al8.922 Fe1.338 Mn.798 Li.42 Zn.06 Ti.018 Si5.568 B6.15 F.26 O42.74 H8.22' _cell_length_a 15.8830 _cell_length_b 15.8830 _cell_length_c 7.1093 _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 120 _cell_volume 1553.183 _exptl_crystal_density_diffrn 4.171 _symmetry_space_group_name_H-M 'R 3 m' loop_ _space_group_symop_operation_xyz 'x,y,z' '2/3+x,1/3+y,1/3+z' '1/3+x,2/3+y,2/3+z' 'x,x-y,z' '2/3+x,1/3+x-y,1/3+z' '1/3+x,2/3+x-y,2/3+z' '-y,-x,z' '2/3-y,1/3-x,1/3+z' '1/3-y,2/3-x,2/3+z' '-x+y,y,z' '2/3-x+y,1/3+y,1/3+z' '1/3-x+y,2/3+y,2/3+z' '-y,x-y,z' '2/3-y,1/3+x-y,1/3+z' '1/3-y,2/3+x-y,2/3+z' '-x+y,-x,z' '2/3-x+y,1/3-x,1/3+z' '1/3-x+y,2/3-x,2/3+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 NaX 0.00000 0.00000 0.25000 0.56000 0.02690 CaX 0.00000 0.00000 0.25000 0.01000 0.02690 KX 0.00000 0.00000 0.25000 0.01000 0.02690 AlY 0.12248 -0.06124 0.34775 0.44000 0.01120 Fe3+Y 0.12248 -0.06124 0.34775 0.15000 0.01120 Mn2+Y 0.12248 -0.06124 0.34775 0.13300 0.01120 Fe2+Y 0.12248 -0.06124 0.34775 0.07300 0.01120 LiY 0.12248 -0.06124 0.34775 0.07000 0.01120 ZnY 0.12248 -0.06124 0.34775 0.01000 0.01120 Ti4+Y 0.12248 -0.06124 0.34775 0.00300 0.01120 AlZ 0.29724 0.26071 0.36897 1.00000 0.00770 SiT 0.19185 0.18983 0.02240 0.92800 0.00710 AlT 0.19185 0.18983 0.02240 0.04700 0.00710 BT 0.19185 0.18983 0.02240 0.02500 0.00710 B 0.10962 -0.21924 0.47500 1.00000 0.00870 F1 0.00000 0.00000 0.20500 0.26000 0.02880 O1 0.00000 0.00000 0.20500 0.74000 0.02880 H1 0.01860 0.03730 0.18200 0.74000 ? O2 0.06098 -0.12196 0.50920 1.00000 0.01780 O3 0.26390 -0.13195 0.47030 1.00000 0.01450 H3 0.25800 -0.12900 0.59100 1.00000 0.04600 O4 0.09416 -0.18832 0.09410 1.00000 0.01180 O5 0.18790 -0.09395 0.11660 1.00000 0.01250 O6 0.19581 0.18530 0.20390 1.00000 0.01040 O7 0.28642 0.28647 0.09970 1.00000 0.00910 O8 0.20963 0.27061 0.46040 1.00000 0.01010