P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 33.044318 12.685165 12.130341 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.01819000 Y=0.25000000 Z=0.78835000
          MULT= 4          ISPLIT= 8
      -1: X=0.98181000 Y=0.75000000 Z=0.21165000
      -1: X=0.51819000 Y=0.25000000 Z=0.71165000
      -1: X=0.48181000 Y=0.75000000 Z=0.28835000
Pb         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  82.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.09760000 Y=0.25000000 Z=0.28120000
          MULT= 4          ISPLIT= 8
      -2: X=0.90240000 Y=0.75000000 Z=0.71880000
      -2: X=0.59760000 Y=0.25000000 Z=0.21880000
      -2: X=0.40240000 Y=0.75000000 Z=0.78120000
P          NPT=  781  R0=.000100000 RMT= 1.87        Z:  15.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.16090000 Y=0.25000000 Z=0.54790000
          MULT= 4          ISPLIT= 8
      -3: X=0.83910000 Y=0.75000000 Z=0.45210000
      -3: X=0.66090000 Y=0.25000000 Z=0.95210000
      -3: X=0.33910000 Y=0.75000000 Z=0.04790000
S          NPT=  781  R0=.000100000 RMT= 1.96        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.48176000 Y=0.25000000 Z=0.15480000
          MULT= 4          ISPLIT= 8
      -4: X=0.51824000 Y=0.75000000 Z=0.84520000
      -4: X=0.98176000 Y=0.25000000 Z=0.34520000
      -4: X=0.01824000 Y=0.75000000 Z=0.65480000
S          NPT=  781  R0=.000100000 RMT= 1.96        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.12167000 Y=0.00390000 Z=0.10530000
          MULT= 8          ISPLIT= 8
      -5: X=0.87833000 Y=0.99610000 Z=0.89470000
      -5: X=0.62167000 Y=0.00390000 Z=0.39470000
      -5: X=0.37833000 Y=0.99610000 Z=0.60530000
      -5: X=0.37833000 Y=0.50390000 Z=0.60530000
      -5: X=0.62167000 Y=0.49610000 Z=0.39470000
      -5: X=0.87833000 Y=0.50390000 Z=0.89470000
      -5: X=0.12167000 Y=0.49610000 Z=0.10530000
S          NPT=  781  R0=.000100000 RMT= 1.96        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.29408000 Y=0.25000000 Z=0.03190000
          MULT= 4          ISPLIT= 8
      -6: X=0.70592000 Y=0.75000000 Z=0.96810000
      -6: X=0.79408000 Y=0.25000000 Z=0.46810000
      -6: X=0.20592000 Y=0.75000000 Z=0.53190000
Rb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  37.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000