CXZ LATTICE,NONEQUIV.ATOMS   6   12 B2/m                                       
MODE OF CALC=RELA unit=bohr                                                    
 31.237173 12.698960  6.859706 90.000000 90.000000 79.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 8
Al         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  13.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.16700000 Y=0.00800000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -2: X=0.83300000 Y=0.99200000 Z=0.00000000
Mg         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  12.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.92000000 Y=0.40300000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -3: X=0.08000000 Y=0.59700000 Z=0.00000000
Mg         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  12.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.55200000 Y=0.24800000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -4: X=0.44800000 Y=0.75200000 Z=0.00000000
Si         NPT=  781  R0=.000100000 RMT= 2.26        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  -5: X=0.71200000 Y=0.71200000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -5: X=0.28800000 Y=0.28800000 Z=0.00000000
Si         NPT=  781  R0=.000100000 RMT= 2.26        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  -6: X=0.69100000 Y=0.34600000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -6: X=0.30900000 Y=0.65400000 Z=0.00000000
Si         NPT=  781  R0=.000100000 RMT= 2.26        Z:  14.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000