#======================================================================

# CRYSTAL DATA

#----------------------------------------------------------------------

data_VESTA_phase_1


_chemical_name_common                  ''
_cell_length_a                         5.1667(14)
_cell_length_b                         8.939(2)
_cell_length_c                         5.1706(9)
_cell_angle_alpha                      90
_cell_angle_beta                       109.53(2)
_cell_angle_gamma                      90
_space_group_name_H-M_alt              'C 2/m'
_space_group_IT_number                 12

loop_
_space_group_symop_operation_xyz
   'x, y, z'
   '-x, -y, -z'
   '-x, y, -z'
   'x, -y, z'
   'x+1/2, y+1/2, z'
   '-x+1/2, -y+1/2, -z'
   '-x+1/2, y+1/2, -z'
   'x+1/2, -y+1/2, z'

loop_
   _atom_site_label
   _atom_site_occupancy
   _atom_site_fract_x
   _atom_site_fract_y
   _atom_site_fract_z
   _atom_site_adp_type
   _atom_site_U_iso_or_equiv
   _atom_site_type_symbol
   O1         1.0     0.303(6)      0.1731(17)    0.200(2)     Uiso  1.000000 O
   O2         1.0     0.762(6)      0.000000      0.222(4)     Uiso  1.000000 O
   Li1        1.0     0.000000      0.116(5)      0.500000     Uiso  1.000000 Li
   Ni         1.0     0.000000      0.3370(7)     0.000000     Uiso  1.000000 Ni
   Li2        1.0     0.000000      0.500000      0.500000     Uiso  1.000000 Li
   Te1        1.0     0.000000      0.000000      0.000000     Uiso  1.000000 Te
