# CIF generated by HEAS from Alexandria entry agm006708564
data_agm006708564
_cell_length_a     5.12733
_cell_length_b     5.12733
_cell_length_c     6.18414
_cell_angle_alpha  90.00000
_cell_angle_beta   90.00000
_cell_angle_gamma  120.00000
_cell_volume       140.79661
_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 0.50000 1.00000
  Ca1 Ca 0.33333 0.66667 0.68251 1.00000
  Ca2 Ca 0.66667 0.33333 0.31749 1.00000
  Ca3 Ca 0.00000 0.00000 0.00000 1.00000
  Ni1 Ni 0.66667 0.33333 0.78780 1.00000
  Ni2 Ni 0.33333 0.66667 0.21220 1.00000
  H1 H 0.67043 0.83522 0.30313 1.00000
  H2 H 0.16478 0.32957 0.30313 1.00000
  H3 H 0.16478 0.83522 0.30313 1.00000
  H4 H 0.83522 0.67043 0.69687 1.00000
  H5 H 0.32957 0.16478 0.69687 1.00000
  H6 H 0.83522 0.16478 0.69687 1.00000