# CIF generated by HEAS from Alexandria entry agm004579596
data_agm004579596
_cell_length_a     5.17097
_cell_length_b     5.17097
_cell_length_c     8.83437
_cell_angle_alpha  90.00000
_cell_angle_beta   90.00000
_cell_angle_gamma  120.00000
_cell_volume       204.57418
_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
  Ca1 Ca 0.33333 0.66667 0.28596 1.00000
  Ca2 Ca 0.66667 0.33333 0.71404 1.00000
  Pm1 Pm 0.00000 0.00000 0.00000 1.00000
  B1 B 0.33333 0.66667 0.83325 1.00000
  B2 B 0.66667 0.33333 0.16675 1.00000
  O1 O 0.31759 0.39063 0.83388 1.00000
  O2 O 0.07304 0.68241 0.83388 1.00000
  O3 O 0.60937 0.92696 0.83388 1.00000
  O4 O 0.68241 0.60937 0.16612 1.00000
  O5 O 0.92696 0.31759 0.16612 1.00000
  O6 O 0.39063 0.07304 0.16612 1.00000