P   LATTICE,NONEQUIV.ATOMS   3  205 Pa-3                                       
MODE OF CALC=RELA unit=bohr                                                    
 15.457960 15.457960 15.457960 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 4
      -1: X=0.50000000 Y=0.00000000 Z=0.50000000
      -1: X=0.50000000 Y=0.50000000 Z=0.00000000
      -1: X=0.00000000 Y=0.50000000 Z=0.50000000
Na         NPT=  781  R0=.000100000 RMT= 2.13        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=0.50000000 Y=0.50000000 Z=0.50000000
          MULT= 4          ISPLIT= 4
      -2: X=0.00000000 Y=0.50000000 Z=0.00000000
      -2: X=0.00000000 Y=0.00000000 Z=0.50000000
      -2: X=0.50000000 Y=0.00000000 Z=0.00000000
Sb         NPT=  781  R0=.000010000 RMT= 1.90        Z:  51.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -3: X=0.05000000 Y=0.45000000 Z=0.22500000
          MULT=24          ISPLIT= 8
      -3: X=0.95000000 Y=0.55000000 Z=0.77500000
      -3: X=0.45000000 Y=0.55000000 Z=0.72500000
      -3: X=0.55000000 Y=0.45000000 Z=0.27500000
      -3: X=0.55000000 Y=0.05000000 Z=0.77500000
      -3: X=0.45000000 Y=0.95000000 Z=0.22500000
      -3: X=0.22500000 Y=0.05000000 Z=0.45000000
      -3: X=0.77500000 Y=0.95000000 Z=0.55000000
      -3: X=0.95000000 Y=0.95000000 Z=0.27500000
      -3: X=0.05000000 Y=0.05000000 Z=0.72500000
      -3: X=0.27500000 Y=0.95000000 Z=0.95000000
      -3: X=0.72500000 Y=0.05000000 Z=0.05000000
      -3: X=0.72500000 Y=0.45000000 Z=0.55000000
      -3: X=0.27500000 Y=0.55000000 Z=0.45000000
      -3: X=0.77500000 Y=0.55000000 Z=0.05000000
      -3: X=0.22500000 Y=0.45000000 Z=0.95000000
      -3: X=0.45000000 Y=0.22500000 Z=0.05000000
      -3: X=0.55000000 Y=0.77500000 Z=0.95000000
      -3: X=0.05000000 Y=0.77500000 Z=0.55000000
      -3: X=0.95000000 Y=0.22500000 Z=0.45000000
      -3: X=0.95000000 Y=0.27500000 Z=0.95000000
      -3: X=0.05000000 Y=0.72500000 Z=0.05000000
      -3: X=0.55000000 Y=0.72500000 Z=0.45000000
      -3: X=0.45000000 Y=0.27500000 Z=0.55000000
F          NPT=  781  R0=.000100000 RMT= 1.72        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000