B   LATTICE,NONEQUIV.ATOMS   4  217 I-43m                                      
MODE OF CALC=RELA unit=bohr                                                    
 21.198192 21.198192 21.198192 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.09110000 Y=0.09110000 Z=0.27884000
          MULT=12          ISPLIT= 8
      -1: X=0.09110000 Y=0.90890000 Z=0.72116000
      -1: X=0.27884000 Y=0.09110000 Z=0.09110000
      -1: X=0.90890000 Y=0.90890000 Z=0.27884000
      -1: X=0.09110000 Y=0.72116000 Z=0.90890000
      -1: X=0.90890000 Y=0.09110000 Z=0.72116000
      -1: X=0.72116000 Y=0.90890000 Z=0.09110000
      -1: X=0.90890000 Y=0.27884000 Z=0.90890000
      -1: X=0.27884000 Y=0.90890000 Z=0.90890000
      -1: X=0.90890000 Y=0.72116000 Z=0.09110000
      -1: X=0.72116000 Y=0.09110000 Z=0.90890000
      -1: X=0.09110000 Y=0.27884000 Z=0.09110000
Sn         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  50.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.25000000 Y=0.50000000 Z=0.00000000
          MULT= 6          ISPLIT=-2
      -2: X=0.50000000 Y=0.75000000 Z=0.00000000
      -2: X=0.75000000 Y=0.50000000 Z=0.00000000
      -2: X=0.50000000 Y=0.25000000 Z=0.00000000
      -2: X=0.00000000 Y=0.50000000 Z=0.75000000
      -2: X=0.00000000 Y=0.50000000 Z=0.25000000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.30590000 Y=0.30590000 Z=0.30590000
          MULT= 4          ISPLIT= 4
      -3: X=0.30590000 Y=0.69410000 Z=0.69410000
      -3: X=0.69410000 Y=0.69410000 Z=0.30590000
      -3: X=0.69410000 Y=0.30590000 Z=0.69410000
Na         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  11.00000              
LOCAL ROT MATRIX:    0.4082483-0.7071068 0.5773503
                     0.4082483 0.7071068 0.5773503
                    -0.8164966 0.0000000 0.5773503
ATOM   4: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 2
Sr         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  38.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000