P   LATTICE,NONEQUIV.ATOMS   5  218 P-43n                                      
MODE OF CALC=RELA unit=bohr                                                    
 16.761871 16.761871 16.761871 90.000000 90.000000 90.000000                   
ATOM   1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 2
       1: X=0.50000000 Y=0.50000000 Z=0.50000000
Cl         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.17770000 Y=0.17770000 Z=0.17770000
          MULT= 8          ISPLIT= 4
      -2: X=0.67770000 Y=0.32230000 Z=0.32230000
      -2: X=0.17770000 Y=0.82230000 Z=0.82230000
      -2: X=0.82230000 Y=0.82230000 Z=0.17770000
      -2: X=0.32230000 Y=0.32230000 Z=0.67770000
      -2: X=0.32230000 Y=0.67770000 Z=0.32230000
      -2: X=0.82230000 Y=0.17770000 Z=0.82230000
      -2: X=0.67770000 Y=0.67770000 Z=0.67770000
Na         NPT=  781  R0=.000100000 RMT= 2.21        Z:  11.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -3: X=0.25000000 Y=0.00000000 Z=0.50000000
          MULT= 6          ISPLIT=-2
      -3: X=0.50000000 Y=0.25000000 Z=0.00000000
      -3: X=0.75000000 Y=0.00000000 Z=0.50000000
      -3: X=0.50000000 Y=0.75000000 Z=0.00000000
      -3: X=0.00000000 Y=0.50000000 Z=0.25000000
      -3: X=0.00000000 Y=0.50000000 Z=0.75000000
Al         NPT=  781  R0=.000100000 RMT= 1.63        Z:  13.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.25000000 Y=0.50000000 Z=0.00000000
          MULT= 6          ISPLIT=-2
      -4: X=0.00000000 Y=0.25000000 Z=0.50000000
      -4: X=0.75000000 Y=0.50000000 Z=0.00000000
      -4: X=0.00000000 Y=0.75000000 Z=0.50000000
      -4: X=0.50000000 Y=0.00000000 Z=0.25000000
      -4: X=0.50000000 Y=0.00000000 Z=0.75000000
Si         NPT=  781  R0=.000100000 RMT= 1.40        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  -5: X=0.13930000 Y=0.14980000 Z=0.43860000
          MULT=24          ISPLIT= 8
      -5: X=0.64980000 Y=0.36070000 Z=0.06140000
      -5: X=0.13930000 Y=0.85020000 Z=0.56140000
      -5: X=0.43860000 Y=0.13930000 Z=0.14980000
      -5: X=0.86070000 Y=0.85020000 Z=0.43860000
      -5: X=0.35020000 Y=0.36070000 Z=0.93860000
      -5: X=0.63930000 Y=0.06140000 Z=0.35020000
      -5: X=0.35020000 Y=0.63930000 Z=0.06140000
      -5: X=0.86070000 Y=0.14980000 Z=0.56140000
      -5: X=0.56140000 Y=0.86070000 Z=0.14980000
      -5: X=0.64980000 Y=0.63930000 Z=0.93860000
      -5: X=0.36070000 Y=0.93860000 Z=0.35020000
      -5: X=0.43860000 Y=0.86070000 Z=0.85020000
      -5: X=0.36070000 Y=0.06140000 Z=0.64980000
      -5: X=0.56140000 Y=0.13930000 Z=0.85020000
      -5: X=0.63930000 Y=0.93860000 Z=0.64980000
      -5: X=0.06140000 Y=0.64980000 Z=0.36070000
      -5: X=0.14980000 Y=0.43860000 Z=0.13930000
      -5: X=0.93860000 Y=0.35020000 Z=0.36070000
      -5: X=0.85020000 Y=0.56140000 Z=0.13930000
      -5: X=0.06140000 Y=0.35020000 Z=0.63930000
      -5: X=0.85020000 Y=0.43860000 Z=0.86070000
      -5: X=0.93860000 Y=0.64980000 Z=0.63930000
      -5: X=0.14980000 Y=0.56140000 Z=0.86070000
O          NPT=  781  R0=.000100000 RMT= 1.63        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000