# generated using pymatgen
data_Y4BBr6
_symmetry_space_group_name_H-M   'P 1'
_cell_length_a   10.62979332
_cell_length_b   10.62996934
_cell_length_c   12.58818530
_cell_angle_alpha   84.32326518
_cell_angle_beta   84.32403815
_cell_angle_gamma   63.63516084
_symmetry_Int_Tables_number   1
_chemical_formula_structural   Y4BBr6
_chemical_formula_sum   'Y16 B4 Br24'
_cell_volume   1265.77986277
_cell_formula_units_Z   4
loop_
 _symmetry_equiv_pos_site_id
 _symmetry_equiv_pos_as_xyz
  1  '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
  Y  Y0  1  0.71339875  0.47032630  0.19155784  1.0
  Y  Y1  1  0.52968652  0.28664477  0.30844521  1.0
  Y  Y2  1  0.28659729  0.52967266  0.80844283  1.0
  Y  Y3  1  0.47032213  0.71334984  0.69155246  1.0
  Y  Y4  1  0.78566772  0.54465765  0.45395801  1.0
  Y  Y5  1  0.45535129  0.21432673  0.04609213  1.0
  Y  Y6  1  0.21433372  0.45534281  0.54604359  1.0
  Y  Y7  1  0.54463249  0.78568355  0.95390886  1.0
  Y  Y8  1  0.58121212  0.35829198  0.58865325  1.0
  Y  Y9  1  0.64170077  0.41879401  0.91136937  1.0
  Y  Y10  1  0.41879322  0.64170532  0.41134700  1.0
  Y  Y11  1  0.35829328  0.58120161  0.08862737  1.0
  Y  Y12  1  0.11422186  0.81335602  0.60508514  1.0
  Y  Y13  1  0.18663943  0.88576423  0.89490560  1.0
  Y  Y14  1  0.88578555  0.18664474  0.39491274  1.0
  Y  Y15  1  0.81336137  0.11423243  0.10508965  1.0
  B  B16  1  0.66237034  0.41166095  0.39489863  1.0
  B  B17  1  0.58834893  0.33764633  0.10510977  1.0
  B  B18  1  0.33763626  0.58833682  0.60509981  1.0
  B  B19  1  0.41165140  0.66234880  0.89488948  1.0
  Br  Br20  1  0.14093468  0.37633010  0.74855348  1.0
  Br  Br21  1  0.62359599  0.85907399  0.75135747  1.0
  Br  Br22  1  0.85906075  0.62366165  0.25143518  1.0
  Br  Br23  1  0.37639288  0.14093930  0.24864373  1.0
  Br  Br24  1  0.15833139  0.91468654  0.39518798  1.0
  Br  Br25  1  0.08531194  0.84166947  0.10478622  1.0
  Br  Br26  1  0.84167981  0.08530948  0.60481103  1.0
  Br  Br27  1  0.91471061  0.15831964  0.89520446  1.0
  Br  Br28  1  0.05549858  0.30665319  0.46653106  1.0
  Br  Br29  1  0.69335966  0.94449692  0.03347711  1.0
  Br  Br30  1  0.94449674  0.69336285  0.53347445  1.0
  Br  Br31  1  0.30663852  0.05550331  0.96653034  1.0
  Br  Br32  1  0.98767440  0.22466716  0.18021737  1.0
  Br  Br33  1  0.77535194  0.01233879  0.31978484  1.0
  Br  Br34  1  0.01231271  0.77534871  0.81977793  1.0
  Br  Br35  1  0.22463666  0.98765963  0.68021693  1.0
  Br  Br36  1  0.46974810  0.74965988  0.18449464  1.0
  Br  Br37  1  0.25030289  0.53027790  0.31546267  1.0
  Br  Br38  1  0.53023899  0.25034745  0.81550715  1.0
  Br  Br39  1  0.74971513  0.46969300  0.68453735  1.0
  Br  Br40  1  0.80903757  0.54680773  0.97404306  1.0
  Br  Br41  1  0.45322475  0.19097483  0.52594343  1.0
  Br  Br42  1  0.19094972  0.45320479  0.02597534  1.0
  Br  Br43  1  0.54678915  0.80902416  0.47405504  1.0