# CIF generated by HEAS from Alexandria entry agm007442829
data_agm007442829
_cell_length_a     5.17374
_cell_length_b     5.17374
_cell_length_c     5.13860
_cell_angle_alpha  90.00000
_cell_angle_beta   90.00000
_cell_angle_gamma  120.00000
_cell_volume       119.11973
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
  'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
  Li1 Li 0.00000 0.00000 0.00000 1.00000
  Ca1 Ca 0.33333 0.66667 0.27578 1.00000
  Ca2 Ca 0.66667 0.33333 0.72422 1.00000
  Nb1 Nb 0.00000 0.00000 0.50000 1.00000
  H1 H 0.16555 0.83445 0.74773 1.00000
  H2 H 0.16555 0.33110 0.74773 1.00000
  H3 H 0.66890 0.83445 0.74773 1.00000
  H4 H 0.83445 0.66890 0.25227 1.00000
  H5 H 0.33110 0.16555 0.25227 1.00000
  H6 H 0.83445 0.16555 0.25227 1.00000