P   LATTICE,NONEQUIV.ATOMS   6  215 P-43m                                      
MODE OF CALC=RELA unit=bohr                                                    
 11.950628 11.950628 11.950628 90.000000 90.000000 90.000000                   
ATOM   1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 2
Si         NPT=  781  R0=.000100000 RMT= 2.38        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=0.50000000 Z=0.50000000
          MULT= 3          ISPLIT=-2
      -2: X=0.50000000 Y=0.00000000 Z=0.50000000
      -2: X=0.50000000 Y=0.50000000 Z=0.00000000
Si         NPT=  781  R0=.000100000 RMT= 2.38        Z:  14.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM   3: X=0.50000000 Y=0.50000000 Z=0.50000000
          MULT= 1          ISPLIT= 2
Li         NPT=  781  R0=.000100000 RMT= 2.31        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.50000000 Y=0.00000000 Z=0.00000000
          MULT= 3          ISPLIT=-2
      -4: X=0.00000000 Y=0.50000000 Z=0.00000000
      -4: X=0.00000000 Y=0.00000000 Z=0.50000000
Li         NPT=  781  R0=.000100000 RMT= 2.31        Z:   3.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.25000000 Y=0.25000000 Z=0.25000000
          MULT= 4          ISPLIT= 4
      -5: X=0.25000000 Y=0.75000000 Z=0.75000000
      -5: X=0.75000000 Y=0.75000000 Z=0.25000000
      -5: X=0.75000000 Y=0.25000000 Z=0.75000000
Li         NPT=  781  R0=.000100000 RMT= 2.31        Z:   3.00000              
LOCAL ROT MATRIX:    0.4082483-0.7071068 0.5773503
                     0.4082483 0.7071068 0.5773503
                    -0.8164966 0.0000000 0.5773503
ATOM  -6: X=0.75000000 Y=0.75000000 Z=0.75000000
          MULT= 4          ISPLIT= 4
      -6: X=0.75000000 Y=0.25000000 Z=0.25000000
      -6: X=0.25000000 Y=0.25000000 Z=0.75000000
      -6: X=0.25000000 Y=0.75000000 Z=0.25000000
Mg         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  12.00000              
LOCAL ROT MATRIX:    0.4082483-0.7071068 0.5773503
                     0.4082483 0.7071068 0.5773503
                    -0.8164966 0.0000000 0.5773503