data_global
_chemical_name_mineral 'Paratimroseite'
loop_
_publ_author_name
'Kampf A R'
'Mills S J'
'Housley R M'
'Marty J'
'Thorne B'
_journal_name_full 'American Mineralogist'
_journal_volume 95 
_journal_year 2010
_journal_page_first 1560
_journal_page_last 1568
_publ_section_title
;
 Lead-tellurium oxysalts from Otto Mountain near Baker, California: V.
 Timroseite, Pb2Cu2+5(Te6+O6)2(OH)2, and paratimroseite,
 Pb2Cu2+4(Te6+O6)2(H2O)2, two new tellurates with Te-Cu polyhedral sheets
;
_database_code_amcsd 0017722
_chemical_compound_source 'Otto Mountain, Baker, California'
_chemical_formula_sum 'Pb Cu2 Te O7 H2'
_cell_length_a 5.1943
_cell_length_b 9.6198
_cell_length_c 11.6746
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 583.358
_exptl_crystal_density_diffrn      6.557
_symmetry_space_group_name_H-M 'P 21 21 21'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '-x,1/2+y,1/2-z'
  '1/2+x,1/2-y,-z'
  '1/2-x,-y,1/2+z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_U_iso_or_equiv
Pb   0.48658   0.37646   0.71849   0.01990
Cu1   0.38020   0.64420   0.54570   0.01480
Cu2   0.42050   0.35130   0.42220   0.01450
Te   0.89860   0.49499   0.49034   0.01240
O1   0.60800   0.52910   0.39140   0.01600
O2   0.19500   0.47300   0.58700   0.01200
O3   0.54400   0.82220   0.53220   0.02300
O4   0.74100   0.31790   0.51880   0.02200
O5   0.41500   0.57150   0.86240   0.01700
O6   0.69600   0.56600   0.61930   0.01900
Wat   0.47300   0.74770   0.26040   0.02400
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
Pb 0.01820 0.02240 0.01920 0.00120 0.00040 0.00410
Cu1 0.00900 0.01570 0.01960 0.00070 -0.00110 0.00120
Cu2 0.00900 0.01590 0.01840 -0.00120 -0.00150 0.00050
Te 0.01000 0.01170 0.01550 0.00000 -0.00030 -0.00030
O1 0.01800 0.01500 0.01600 -0.00700 -0.01200 0.00200
O4 0.01800 0.00700 0.04100 -0.01000 0.00300 0.00500
O5 0.00700 0.03200 0.01200 0.00000 0.00000 -0.00300
O6 0.01800 0.02800 0.01100 0.00100 0.01000 -0.00200
Wat 0.04300 0.00800 0.02000 -0.00300 0.00800 -0.00500