Pb2[B5O9]Br
Yakubovich O V, Mochenova N N, Dimitrova O V, Massa W
Acta Crystallographica E60 (2004) i127-i130
Reinvestigation of the Pb2[B5O9]Br structure based on single-crystal data
_database_code_amcsd 0010437
11.4935 11.4717 6.5297 90 90 90 Pnn2
atom      x      y       z   Uiso U(1,1) U(2,2) U(3,3) U(1,2) U(1,3) U(2,3)
Pb1  .25762 .04280  .00433 .01489  .0172  .0170  .0105  .0011  .0010  .0004
Pb2  .02631 .23505 -.66205 .01614  .0187  .0179  .0118 -.0013  .0034  .0000
B1    .2706  .3217   -.795   .008
B2    .1803  .3009   -.146   .012
B3    .2864  .2180   -.460   .010
B4    .4556  .2354   -.683   .011
B5    .2513  .4950   -.019   .009
O1    .2376  .3135  -.5784  .0030
O2    .2084  .4248   -.173  .0108
O3    .2717  .2256  -.2448  .0079
O4    .0686  .2753  -.2398   .017
O5    .2790  .4487   -.835   .015
O6    .3827  .2616  -.8357  .0092
O7    .1785  .2698  -.9231  .0046
O8    .4168  .2110  -.4921  .0090
O9    .2339  .1103  -.5577  .0106
Br1       0      0  -.9081  .0289  .0202  .0154  .0511 -.0011      0      0
Br2       0     .5  -.6476  .0259  .0188  .0179  .0411  .0002      0      0