CXY LATTICE,NONEQUIV.ATOMS   8   36 Cmc21                                      
MODE OF CALC=RELA unit=bohr                                                    
 48.282503 10.385935 10.385935 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.25824000 Z=0.03039000
          MULT= 2          ISPLIT= 8
      -1: X=0.00000000 Y=0.74176000 Z=0.53039000
Pb         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  82.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -2: X=0.20026000 Y=0.22132000 Z=0.05502000
          MULT= 4          ISPLIT= 8
      -2: X=0.79974000 Y=0.77868000 Z=0.55502000
      -2: X=0.79974000 Y=0.22132000 Z=0.05502000
      -2: X=0.20026000 Y=0.77868000 Z=0.55502000
Bi         NPT=  781  R0=.000005000 RMT= 2.29        Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.41300000 Y=0.25240000 Z=0.02244000
          MULT= 4          ISPLIT= 8
      -3: X=0.58700000 Y=0.74760000 Z=0.52244000
      -3: X=0.58700000 Y=0.25240000 Z=0.02244000
      -3: X=0.41300000 Y=0.74760000 Z=0.52244000
Nb         NPT=  781  R0=.000010000 RMT= 1.88        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.30289000 Z=0.49148000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.69711000 Z=0.99148000
O          NPT=  781  R0=.000100000 RMT= 1.70        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -5: X=0.15988000 Y=0.17855000 Z=0.49611000
          MULT= 4          ISPLIT= 8
      -5: X=0.84012000 Y=0.82145000 Z=0.99611000
      -5: X=0.84012000 Y=0.17855000 Z=0.49611000
      -5: X=0.15988000 Y=0.82145000 Z=0.99611000
O          NPT=  781  R0=.000100000 RMT= 1.70        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.24845000 Y=0.49281000 Z=0.28724000
          MULT= 4          ISPLIT= 8
      -6: X=0.75155000 Y=0.50719000 Z=0.78724000
      -6: X=0.75155000 Y=0.49281000 Z=0.28724000
      -6: X=0.24845000 Y=0.50719000 Z=0.78724000
O          NPT=  781  R0=.000100000 RMT= 1.70        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.43090000 Y=0.48977000 Z=0.26230000
          MULT= 4          ISPLIT= 8
      -7: X=0.56910000 Y=0.51023000 Z=0.76230000
      -7: X=0.56910000 Y=0.48977000 Z=0.26230000
      -7: X=0.43090000 Y=0.51023000 Z=0.76230000
O          NPT=  781  R0=.000100000 RMT= 1.70        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.08889000 Y=0.47094000 Z=0.22412000
          MULT= 4          ISPLIT= 8
      -8: X=0.91111000 Y=0.52906000 Z=0.72412000
      -8: X=0.91111000 Y=0.47094000 Z=0.22412000
      -8: X=0.08889000 Y=0.52906000 Z=0.72412000
O          NPT=  781  R0=.000100000 RMT= 1.70        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000