# CIF generated by HEAS from Alexandria entry agm005756381
data_agm005756381
_cell_length_a     6.27185
_cell_length_b     6.27185
_cell_length_c     6.41792
_cell_angle_alpha  99.26925
_cell_angle_beta   99.26930
_cell_angle_gamma  119.92909
_cell_volume       207.15119
_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 0.62463 0.95796 0.78691 1.00000
  Zr2 Zr 0.04203 0.37537 0.21309 1.00000
  Zr3 Zr 0.90079 0.59431 0.78401 1.00000
  Zr4 Zr 0.26097 0.23412 0.78401 1.00000
  Zr5 Zr 0.40569 0.09921 0.21599 1.00000
  Zr6 Zr 0.76588 0.73903 0.21599 1.00000
  B1 B 0.00074 0.99926 1.00000 1.00000
  B2 B 0.66593 0.33407 0.00000 1.00000
  S1 S 0.83335 0.16665 0.50000 1.00000
  S2 S 0.33333 0.66667 0.00000 1.00000
  S3 S 0.17249 0.82751 0.50000 1.00000
  S4 S 0.49419 0.50581 0.50000 1.00000