P   LATTICE,NONEQUIV.ATOMS   4  205 Pa-3                                       
MODE OF CALC=RELA unit=bohr                                                    
 15.287884 15.287884 15.287884 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.50000000 Y=0.50000000 Z=0.50000000
          MULT= 4          ISPLIT= 4
      -1: X=0.00000000 Y=0.50000000 Z=0.00000000
      -1: X=0.00000000 Y=0.00000000 Z=0.50000000
      -1: X=0.50000000 Y=0.00000000 Z=0.00000000
Na         NPT=  781  R0=.000100000 RMT= 2.09        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  -2: X=0.25000000 Y=0.25000000 Z=0.25000000
          MULT= 8          ISPLIT= 4
      -2: X=0.75000000 Y=0.75000000 Z=0.75000000
      -2: X=0.25000000 Y=0.75000000 Z=0.75000000
      -2: X=0.75000000 Y=0.25000000 Z=0.25000000
      -2: X=0.75000000 Y=0.25000000 Z=0.75000000
      -2: X=0.25000000 Y=0.75000000 Z=0.25000000
      -2: X=0.75000000 Y=0.75000000 Z=0.25000000
      -2: X=0.25000000 Y=0.25000000 Z=0.75000000
K          NPT=  781  R0=.000050000 RMT= 2.42        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=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 4
      -3: X=0.50000000 Y=0.00000000 Z=0.50000000
      -3: X=0.50000000 Y=0.50000000 Z=0.00000000
      -3: X=0.00000000 Y=0.50000000 Z=0.50000000
Al         NPT=  781  R0=.000100000 RMT= 1.65        Z:  13.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -4: X=0.01000000 Y=0.22000000 Z=0.03000000
          MULT=24          ISPLIT= 8
      -4: X=0.99000000 Y=0.78000000 Z=0.97000000
      -4: X=0.49000000 Y=0.78000000 Z=0.53000000
      -4: X=0.51000000 Y=0.22000000 Z=0.47000000
      -4: X=0.51000000 Y=0.28000000 Z=0.97000000
      -4: X=0.49000000 Y=0.72000000 Z=0.03000000
      -4: X=0.03000000 Y=0.01000000 Z=0.22000000
      -4: X=0.97000000 Y=0.99000000 Z=0.78000000
      -4: X=0.99000000 Y=0.72000000 Z=0.47000000
      -4: X=0.01000000 Y=0.28000000 Z=0.53000000
      -4: X=0.47000000 Y=0.99000000 Z=0.72000000
      -4: X=0.53000000 Y=0.01000000 Z=0.28000000
      -4: X=0.53000000 Y=0.49000000 Z=0.78000000
      -4: X=0.47000000 Y=0.51000000 Z=0.22000000
      -4: X=0.97000000 Y=0.51000000 Z=0.28000000
      -4: X=0.03000000 Y=0.49000000 Z=0.72000000
      -4: X=0.22000000 Y=0.03000000 Z=0.01000000
      -4: X=0.78000000 Y=0.97000000 Z=0.99000000
      -4: X=0.28000000 Y=0.97000000 Z=0.51000000
      -4: X=0.72000000 Y=0.03000000 Z=0.49000000
      -4: X=0.72000000 Y=0.47000000 Z=0.99000000
      -4: X=0.28000000 Y=0.53000000 Z=0.01000000
      -4: X=0.78000000 Y=0.53000000 Z=0.49000000
      -4: X=0.22000000 Y=0.47000000 Z=0.51000000
F          NPT=  781  R0=.000100000 RMT= 1.73        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000