data_global
_amcsd_formula_title 'La2 Mo2 O7'
loop_
_publ_author_name
'Moini A'
'Subramanian M'
'Clearfield A'
'DiSalvo F'
'McCarroll W'
_journal_name_full 'Journal of Solid State Chemistry'
_journal_volume 66 
_journal_year 1987
_journal_page_first 136
_journal_page_last 143
_publ_section_title
;
 Structure and properties of La2 Mo2 O7: A quasi-twodimensional metallic
 oxide with strong Mo-Mo bonds
 _cod_database_code 1005043
;
_database_code_amcsd 0013591
_chemical_formula_sum 'La2 Mo2 O7'
_cell_length_a 6.034
_cell_length_b 12.236
_cell_length_c 3.888
_cell_angle_alpha 90
_cell_angle_beta 90
_cell_angle_gamma 90
_cell_volume 287.059
_exptl_crystal_density_diffrn      6.730
_symmetry_space_group_name_H-M 'P n n m'
loop_
_space_group_symop_operation_xyz
  'x,y,z'
  '1/2+x,1/2-y,1/2+z'
  '1/2-x,1/2+y,1/2-z'
  '1/2-x,1/2+y,1/2+z'
  '1/2+x,1/2-y,1/2-z'
  'x,y,-z'
  '-x,-y,z'
  '-x,-y,-z'
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
La1   0.40970   0.34510   0.00000
Mo1   0.31860   0.04748   0.00000
O1   0.00000   0.00000   0.00000
O2   0.15800   0.19810   0.00000
O3   0.37600   0.88430   0.00000
O4   0.20800   0.54730   0.00000
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
La1 0.64558 2.80641 0.24506 -0.56106 0.00000 0.00000
Mo1 0.23979 0.75849 0.16848 0.03740 0.00000 0.00000
O1 2.58231 5.30942 0.45949 1.12211 0.00000 0.00000
O2 0.55335 5.30942 0.76581 1.49615 0.00000 0.00000
O3 0.92225 5.30942 0.22974 0.37404 0.00000 0.00000
O4 1.84451 9.86035 0.30633 -3.36634 0.00000 0.00000