B   LATTICE,NONEQUIV.ATOMS   2  220 I-43d                                      
MODE OF CALC=RELA unit=bohr                                                    
 12.774549 12.774549 12.774549 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.37500000 Y=0.00000000 Z=0.25000000
          MULT= 6          ISPLIT=-2
      -1: X=0.25000000 Y=0.37500000 Z=0.00000000
      -1: X=0.62500000 Y=0.50000000 Z=0.25000000
      -1: X=0.25000000 Y=0.62500000 Z=0.50000000
      -1: X=0.00000000 Y=0.25000000 Z=0.37500000
      -1: X=0.00000000 Y=0.75000000 Z=0.12500000
Hf         NPT=  781  R0=.000005000 RMT= 2.27        Z:  72.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.06300000 Y=0.06300000 Z=0.06300000
          MULT= 8          ISPLIT= 4
      -2: X=0.31300000 Y=0.68700000 Z=0.18700000
      -2: X=0.06300000 Y=0.93700000 Z=0.43700000
      -2: X=0.93700000 Y=0.43700000 Z=0.06300000
      -2: X=0.18700000 Y=0.68700000 Z=0.81300000
      -2: X=0.18700000 Y=0.31300000 Z=0.68700000
      -2: X=0.93700000 Y=0.56300000 Z=0.43700000
      -2: X=0.31300000 Y=0.31300000 Z=0.31300000
N          NPT=  781  R0=.000100000 RMT= 1.86        Z:   7.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503