data_image0
_chemical_formula_structural       Br2Zr2
_chemical_formula_sum              "Br2 Zr2"
_cell_length_a       3.522324
_cell_length_b       3.522323944262935
_cell_length_c       9.659839747537326
_cell_angle_alpha    79.4951998434178
_cell_angle_beta     100.50480195403739
_cell_angle_gamma    120.00000052345194

_space_group_name_H-M_alt    "P 1"
_space_group_IT_number       1

loop_
  _space_group_symop_operation_xyz
  'x, y, z'

loop_
  _atom_site_type_symbol
  _atom_site_label
  _atom_site_symmetry_multiplicity
  _atom_site_fract_x
  _atom_site_fract_y
  _atom_site_fract_z
  _atom_site_occupancy
  Br  Br1       1.0  0.39135081220000006  0.6086469216  0.1740547028  1.0000
  Br  Br2       1.0  0.6086476067  0.3913502339  0.8259449795  1.0000
  Zr  Zr1       1.0  0.7918812622  0.2081195429  0.3756441171  1.0000
  Zr  Zr2       1.0  0.20811914880000007  0.7918805379000001  0.6243566242  1.0000