P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 32.210382 12.585576 12.232197 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.29080000 Y=0.25000000 Z=0.00030000
          MULT= 4          ISPLIT= 8
      -1: X=0.70920000 Y=0.75000000 Z=0.99970000
      -1: X=0.79080000 Y=0.25000000 Z=0.49970000
      -1: X=0.20920000 Y=0.75000000 Z=0.50030000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.02030000 Y=0.25000000 Z=0.78610000
          MULT= 4          ISPLIT= 8
      -2: X=0.97970000 Y=0.75000000 Z=0.21390000
      -2: X=0.52030000 Y=0.25000000 Z=0.71390000
      -2: X=0.47970000 Y=0.75000000 Z=0.28610000
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  -3: X=0.09910000 Y=0.25000000 Z=0.28210000
          MULT= 4          ISPLIT= 8
      -3: X=0.90090000 Y=0.75000000 Z=0.71790000
      -3: X=0.59910000 Y=0.25000000 Z=0.21790000
      -3: X=0.40090000 Y=0.75000000 Z=0.78210000
P          NPT=  781  R0=.000100000 RMT= 1.86        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  -4: X=0.16500000 Y=0.25000000 Z=0.54350000
          MULT= 4          ISPLIT= 8
      -4: X=0.83500000 Y=0.75000000 Z=0.45650000
      -4: X=0.66500000 Y=0.25000000 Z=0.95650000
      -4: X=0.33500000 Y=0.75000000 Z=0.04350000
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=0.48000000 Y=0.25000000 Z=0.15350000
          MULT= 4          ISPLIT= 8
      -5: X=0.52000000 Y=0.75000000 Z=0.84650000
      -5: X=0.98000000 Y=0.25000000 Z=0.34650000
      -5: X=0.02000000 Y=0.75000000 Z=0.65350000
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  -6: X=0.12400000 Y=0.00340000 Z=0.10610000
          MULT= 8          ISPLIT= 8
      -6: X=0.87600000 Y=0.99660000 Z=0.89390000
      -6: X=0.62400000 Y=0.00340000 Z=0.39390000
      -6: X=0.37600000 Y=0.99660000 Z=0.60610000
      -6: X=0.37600000 Y=0.50340000 Z=0.60610000
      -6: X=0.62400000 Y=0.49660000 Z=0.39390000
      -6: X=0.87600000 Y=0.50340000 Z=0.89390000
      -6: X=0.12400000 Y=0.49660000 Z=0.10610000
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