P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 22.313886 10.920727 17.911580 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.08139000 Y=0.25000000 Z=0.58205000
          MULT= 4          ISPLIT= 8
      -1: X=0.91861000 Y=0.75000000 Z=0.41795000
      -1: X=0.58139000 Y=0.25000000 Z=0.91795000
      -1: X=0.41861000 Y=0.75000000 Z=0.08205000
Pb         NPT=  781  R0=.000005000 RMT= 2.29        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=0.28178000 Y=0.25000000 Z=0.86829000
          MULT= 4          ISPLIT= 8
      -2: X=0.71822000 Y=0.75000000 Z=0.13171000
      -2: X=0.78178000 Y=0.25000000 Z=0.63171000
      -2: X=0.21822000 Y=0.75000000 Z=0.36829000
Pb         NPT=  781  R0=.000005000 RMT= 2.29        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=0.05981000 Y=0.25000000 Z=0.20413000
          MULT= 4          ISPLIT= 8
      -3: X=0.94019000 Y=0.75000000 Z=0.79587000
      -3: X=0.55981000 Y=0.25000000 Z=0.29587000
      -3: X=0.44019000 Y=0.75000000 Z=0.70413000
Pb         NPT=  781  R0=.000005000 RMT= 2.29        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  -4: X=0.31030000 Y=0.25000000 Z=0.19400000
          MULT= 4          ISPLIT= 8
      -4: X=0.68970000 Y=0.75000000 Z=0.80600000
      -4: X=0.81030000 Y=0.25000000 Z=0.30600000
      -4: X=0.18970000 Y=0.75000000 Z=0.69400000
Cl         NPT=  781  R0=.000100000 RMT= 2.44        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.36430000 Y=0.25000000 Z=0.58110000
          MULT= 4          ISPLIT= 8
      -5: X=0.63570000 Y=0.75000000 Z=0.41890000
      -5: X=0.86430000 Y=0.25000000 Z=0.91890000
      -5: X=0.13570000 Y=0.75000000 Z=0.08110000
Cl         NPT=  781  R0=.000100000 RMT= 2.44        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.07930000 Y=0.00520000 Z=0.38730000
          MULT= 8          ISPLIT= 8
      -6: X=0.92070000 Y=0.99480000 Z=0.61270000
      -6: X=0.57930000 Y=0.00520000 Z=0.11270000
      -6: X=0.42070000 Y=0.99480000 Z=0.88730000
      -6: X=0.42070000 Y=0.50520000 Z=0.88730000
      -6: X=0.57930000 Y=0.49480000 Z=0.11270000
      -6: X=0.92070000 Y=0.50520000 Z=0.61270000
      -6: X=0.07930000 Y=0.49480000 Z=0.38730000
O          NPT=  781  R0=.000100000 RMT= 1.87        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000