R   LATTICE,NONEQUIV.ATOMS   5  166 R-3m                                       
MODE OF CALC=RELA unit=bohr                                                    
 14.244755 14.244755 20.815331 90.000000 90.000000120.000000                   
ATOM  -1: X=0.09660000 Y=0.09660000 Z=0.09660000
          MULT= 2          ISPLIT= 4
      -1: X=0.90340000 Y=0.90340000 Z=0.90340000
Be         NPT=  781  R0=.000100000 RMT= 2.00        Z:   4.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.50000000
          MULT= 3          ISPLIT= 8
      -2: X=0.00000000 Y=0.50000000 Z=0.00000000
      -2: X=0.50000000 Y=0.00000000 Z=0.00000000
Be         NPT=  781  R0=.000100000 RMT= 2.00        Z:   4.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.28750000 Y=0.71250000 Z=0.00000000
          MULT= 6          ISPLIT= 8
      -3: X=0.71250000 Y=0.28750000 Z=0.00000000
      -3: X=0.71250000 Y=0.00000000 Z=0.28750000
      -3: X=0.28750000 Y=0.00000000 Z=0.71250000
      -3: X=0.00000000 Y=0.28750000 Z=0.71250000
      -3: X=0.00000000 Y=0.71250000 Z=0.28750000
Be         NPT=  781  R0=.000100000 RMT= 2.00        Z:   4.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.65743000 Y=0.16055000 Z=0.65743000
          MULT= 6          ISPLIT= 8
      -4: X=0.34257000 Y=0.83945000 Z=0.34257000
      -4: X=0.16055000 Y=0.65743000 Z=0.65743000
      -4: X=0.83945000 Y=0.34257000 Z=0.34257000
      -4: X=0.65743000 Y=0.65743000 Z=0.16055000
      -4: X=0.34257000 Y=0.34257000 Z=0.83945000
Be         NPT=  781  R0=.000100000 RMT= 2.00        Z:   4.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.33753000 Y=0.33753000 Z=0.33753000
          MULT= 2          ISPLIT= 4
      -5: X=0.66247000 Y=0.66247000 Z=0.66247000
Zr         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  40.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000