# CIF generated by HEAS from Alexandria entry agm004777458
data_agm004777458
_cell_length_a     3.31584
_cell_length_b     5.66645
_cell_length_c     10.92790
_cell_angle_alpha  90.00000
_cell_angle_beta   90.00000
_cell_angle_gamma  107.01283
_cell_volume       196.33982
_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
  Zr1 Zr 0.36507 0.73015 0.55367 1.00000
  Zr2 Zr 0.63493 0.26985 0.05367 1.00000
  Zr3 Zr 0.63493 0.26985 0.44633 1.00000
  Zr4 Zr 0.36507 0.73015 0.94633 1.00000
  Pa1 Pa 0.09406 0.18811 0.75000 1.00000
  Pa2 Pa 0.90594 0.81189 0.25000 1.00000
  B1 B 0.81956 0.63912 0.75000 1.00000
  B2 B 0.18044 0.36088 0.25000 1.00000
  C1 C 0.26983 0.53965 0.13259 1.00000
  C2 C 0.73017 0.46035 0.63259 1.00000
  C3 C 0.73017 0.46035 0.86741 1.00000
  C4 C 0.26983 0.53965 0.36741 1.00000
  C5 C 0.00000 0.00000 0.50000 1.00000
  C6 C 0.00000 0.00000 0.00000 1.00000
  C7 C 0.43326 0.86652 0.75000 1.00000
  C8 C 0.56674 0.13348 0.25000 1.00000