P   LATTICE,NONEQUIV.ATOMS   3  224 Pn-3m                                      
MODE OF CALC=RELA unit=bohr                                                    
 11.694570 11.694570 11.694570 90.000000 90.000000 90.000000                   
ATOM   1: X=0.25000000 Y=0.25000000 Z=0.25000000
          MULT= 2          ISPLIT= 2
       1: X=0.75000000 Y=0.75000000 Z=0.75000000
Si         NPT=  781  R0=.000100000 RMT= 1.41        Z:  14.00000              
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=0.00000000
          MULT= 4          ISPLIT= 4
      -2: X=0.00000000 Y=0.50000000 Z=0.50000000
      -2: X=0.50000000 Y=0.50000000 Z=0.00000000
      -2: X=0.50000000 Y=0.00000000 Z=0.50000000
C          NPT=  781  R0=.000100000 RMT= 1.01        Z:   6.00000              
LOCAL ROT MATRIX:    0.4082483-0.7071068 0.5773503
                     0.4082483 0.7071068 0.5773503
                    -0.8164966 0.0000000 0.5773503
ATOM  -3: X=0.10300000 Y=0.10300000 Z=0.10300000
          MULT= 8          ISPLIT= 4
      -3: X=0.89700000 Y=0.89700000 Z=0.89700000
      -3: X=0.89700000 Y=0.60300000 Z=0.60300000
      -3: X=0.10300000 Y=0.39700000 Z=0.39700000
      -3: X=0.39700000 Y=0.39700000 Z=0.10300000
      -3: X=0.60300000 Y=0.60300000 Z=0.89700000
      -3: X=0.60300000 Y=0.89700000 Z=0.60300000
      -3: X=0.39700000 Y=0.10300000 Z=0.39700000
N          NPT=  781  R0=.000100000 RMT= 1.06        Z:   7.00000              
LOCAL ROT MATRIX:    0.4082483-0.7071068 0.5773503
                     0.4082483 0.7071068 0.5773503
                    -0.8164966 0.0000000 0.5773503