B   LATTICE,NONEQUIV.ATOMS   3  206 Ia-3                                       
MODE OF CALC=RELA unit=bohr                                                    
 25.337448 25.337448 25.337448 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 4
      -1: X=0.00000000 Y=0.50000000 Z=0.00000000
      -1: X=0.00000000 Y=0.00000000 Z=0.50000000
      -1: X=0.00000000 Y=0.50000000 Z=0.50000000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -2: X=0.26700000 Y=0.00000000 Z=0.25000000
          MULT=12          ISPLIT= 8
      -2: X=0.73300000 Y=0.00000000 Z=0.75000000
      -2: X=0.73300000 Y=0.50000000 Z=0.25000000
      -2: X=0.26700000 Y=0.50000000 Z=0.75000000
      -2: X=0.25000000 Y=0.26700000 Z=0.00000000
      -2: X=0.75000000 Y=0.73300000 Z=0.00000000
      -2: X=0.75000000 Y=0.23300000 Z=0.00000000
      -2: X=0.25000000 Y=0.76700000 Z=0.00000000
      -2: X=0.00000000 Y=0.25000000 Z=0.26700000
      -2: X=0.00000000 Y=0.75000000 Z=0.73300000
      -2: X=0.00000000 Y=0.75000000 Z=0.23300000
      -2: X=0.00000000 Y=0.25000000 Z=0.76700000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.11800000 Y=0.36800000 Z=0.12700000
          MULT=24          ISPLIT= 8
      -3: X=0.88200000 Y=0.63200000 Z=0.87300000
      -3: X=0.88200000 Y=0.13200000 Z=0.12700000
      -3: X=0.11800000 Y=0.86800000 Z=0.87300000
      -3: X=0.11800000 Y=0.63200000 Z=0.37300000
      -3: X=0.88200000 Y=0.36800000 Z=0.62700000
      -3: X=0.12700000 Y=0.11800000 Z=0.36800000
      -3: X=0.87300000 Y=0.88200000 Z=0.63200000
      -3: X=0.88200000 Y=0.86800000 Z=0.37300000
      -3: X=0.11800000 Y=0.13200000 Z=0.62700000
      -3: X=0.87300000 Y=0.38200000 Z=0.36800000
      -3: X=0.12700000 Y=0.61800000 Z=0.63200000
      -3: X=0.12700000 Y=0.88200000 Z=0.13200000
      -3: X=0.87300000 Y=0.11800000 Z=0.86800000
      -3: X=0.87300000 Y=0.61800000 Z=0.13200000
      -3: X=0.12700000 Y=0.38200000 Z=0.86800000
      -3: X=0.36800000 Y=0.12700000 Z=0.11800000
      -3: X=0.63200000 Y=0.87300000 Z=0.88200000
      -3: X=0.63200000 Y=0.37300000 Z=0.11800000
      -3: X=0.36800000 Y=0.62700000 Z=0.88200000
      -3: X=0.36800000 Y=0.87300000 Z=0.38200000
      -3: X=0.63200000 Y=0.12700000 Z=0.61800000
      -3: X=0.63200000 Y=0.62700000 Z=0.38200000
      -3: X=0.36800000 Y=0.37300000 Z=0.61800000
Mg         NPT=  781  R0=.000100000 RMT= 2.44        Z:  12.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000