B   LATTICE,NONEQUIV.ATOMS   3  214 I4132   
MODE OF CALC=RELA unit=bohr
 22.973401 22.973401 22.973401 90.000000 90.000000 90.000000
ATOM  -1: X=0.12500000 Y=0.11624000 Z=0.36624000
          MULT=12          ISPLIT=15
      -1: X=0.13376000 Y=0.87500000 Z=0.61624000
      -1: X=0.12500000 Y=0.88376000 Z=0.13376000
      -1: X=0.36624000 Y=0.12500000 Z=0.11624000
      -1: X=0.87500000 Y=0.38376000 Z=0.36624000
      -1: X=0.36624000 Y=0.87500000 Z=0.38376000
      -1: X=0.87500000 Y=0.61624000 Z=0.13376000
      -1: X=0.13376000 Y=0.12500000 Z=0.88376000
      -1: X=0.61624000 Y=0.13376000 Z=0.87500000
      -1: X=0.11624000 Y=0.36624000 Z=0.12500000
      -1: X=0.88376000 Y=0.86624000 Z=0.37500000
      -1: X=0.88376000 Y=0.13376000 Z=0.12500000
La         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  57.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.12500000 Y=0.61790000 Z=0.63210000
          MULT=12          ISPLIT=15
      -2: X=0.63210000 Y=0.87500000 Z=0.88210000
      -2: X=0.12500000 Y=0.38210000 Z=0.86790000
      -2: X=0.63210000 Y=0.12500000 Z=0.61790000
      -2: X=0.87500000 Y=0.88210000 Z=0.63210000
      -2: X=0.86790000 Y=0.87500000 Z=0.11790000
      -2: X=0.86790000 Y=0.12500000 Z=0.38210000
      -2: X=0.87500000 Y=0.11790000 Z=0.86790000
      -2: X=0.88210000 Y=0.63210000 Z=0.87500000
      -2: X=0.61790000 Y=0.63210000 Z=0.12500000
      -2: X=0.61790000 Y=0.36790000 Z=0.37500000
      -2: X=0.38210000 Y=0.86790000 Z=0.12500000
Br         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  35.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.12500000 Y=0.12500000 Z=0.12500000
          MULT= 4          ISPLIT=15
      -3: X=0.12500000 Y=0.87500000 Z=0.37500000
      -3: X=0.87500000 Y=0.37500000 Z=0.12500000
      -3: X=0.37500000 Y=0.12500000 Z=0.87500000
Si         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  14.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000