P   LATTICE,NONEQUIV.ATOMS   5  218 P-43n                                      
MODE OF CALC=RELA unit=bohr                                                    
 17.485636 17.485636 17.485636 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=0.18760000 Y=0.18760000 Z=0.18760000
          MULT= 8          ISPLIT= 4
      -2: X=0.68760000 Y=0.31240000 Z=0.31240000
      -2: X=0.18760000 Y=0.81240000 Z=0.81240000
      -2: X=0.81240000 Y=0.81240000 Z=0.18760000
      -2: X=0.31240000 Y=0.31240000 Z=0.68760000
      -2: X=0.31240000 Y=0.68760000 Z=0.31240000
      -2: X=0.81240000 Y=0.18760000 Z=0.81240000
      -2: X=0.68760000 Y=0.68760000 Z=0.68760000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
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= 1.71        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= 1.33        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=0.13630000 Y=0.15860000 Z=0.47860000
          MULT=24          ISPLIT= 8
      -5: X=0.65860000 Y=0.36370000 Z=0.02140000
      -5: X=0.13630000 Y=0.84140000 Z=0.52140000
      -5: X=0.47860000 Y=0.13630000 Z=0.15860000
      -5: X=0.86370000 Y=0.84140000 Z=0.47860000
      -5: X=0.34140000 Y=0.36370000 Z=0.97860000
      -5: X=0.63630000 Y=0.02140000 Z=0.34140000
      -5: X=0.34140000 Y=0.63630000 Z=0.02140000
      -5: X=0.86370000 Y=0.15860000 Z=0.52140000
      -5: X=0.52140000 Y=0.86370000 Z=0.15860000
      -5: X=0.65860000 Y=0.63630000 Z=0.97860000
      -5: X=0.36370000 Y=0.97860000 Z=0.34140000
      -5: X=0.47860000 Y=0.86370000 Z=0.84140000
      -5: X=0.36370000 Y=0.02140000 Z=0.65860000
      -5: X=0.52140000 Y=0.13630000 Z=0.84140000
      -5: X=0.63630000 Y=0.97860000 Z=0.65860000
      -5: X=0.02140000 Y=0.65860000 Z=0.36370000
      -5: X=0.15860000 Y=0.47860000 Z=0.13630000
      -5: X=0.97860000 Y=0.34140000 Z=0.36370000
      -5: X=0.84140000 Y=0.52140000 Z=0.13630000
      -5: X=0.02140000 Y=0.34140000 Z=0.63630000
      -5: X=0.84140000 Y=0.47860000 Z=0.86370000
      -5: X=0.97860000 Y=0.65860000 Z=0.63630000
      -5: X=0.15860000 Y=0.52140000 Z=0.86370000
O          NPT=  781  R0=.000100000 RMT= 1.55        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000