P   LATTICE,NONEQUIV.ATOMS   8   57 Pbcm                                       
MODE OF CALC=RELA unit=bohr                                                    
 12.491090 24.778089 24.700610 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.54330000 Y=0.01774000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -1: X=0.45670000 Y=0.98226000 Z=0.75000000
      -1: X=0.45670000 Y=0.51774000 Z=0.25000000
      -1: X=0.54330000 Y=0.48226000 Z=0.75000000
Hg         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  80.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.53960000 Y=0.25000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.46040000 Y=0.75000000 Z=0.00000000
      -2: X=0.53960000 Y=0.25000000 Z=0.50000000
      -2: X=0.46040000 Y=0.75000000 Z=0.50000000
Hg         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  80.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.01030000 Y=0.75649000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -3: X=0.98970000 Y=0.24351000 Z=0.75000000
      -3: X=0.98970000 Y=0.25649000 Z=0.25000000
      -3: X=0.01030000 Y=0.74351000 Z=0.75000000
Tl         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  81.00000              
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=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.00000000 Y=0.00000000 Z=0.50000000
      -4: X=0.00000000 Y=0.50000000 Z=0.00000000
      -4: X=0.00000000 Y=0.50000000 Z=0.50000000
Hg         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  80.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.63130000 Y=0.05991000 Z=0.05525000
          MULT= 8          ISPLIT= 8
      -5: X=0.36870000 Y=0.94009000 Z=0.94475000
      -5: X=0.63130000 Y=0.05991000 Z=0.44475000
      -5: X=0.36870000 Y=0.94009000 Z=0.55525000
      -5: X=0.36870000 Y=0.55991000 Z=0.05525000
      -5: X=0.63130000 Y=0.44009000 Z=0.94475000
      -5: X=0.36870000 Y=0.55991000 Z=0.44475000
      -5: X=0.63130000 Y=0.44009000 Z=0.55525000
Sb         NPT=  781  R0=.000010000 RMT= 2.44        Z:  51.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.10480000 Y=0.25000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -6: X=0.89520000 Y=0.75000000 Z=0.00000000
      -6: X=0.10480000 Y=0.25000000 Z=0.50000000
      -6: X=0.89520000 Y=0.75000000 Z=0.50000000
Br         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -7: X=0.10680000 Y=0.00890000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -7: X=0.89320000 Y=0.99110000 Z=0.75000000
      -7: X=0.89320000 Y=0.50890000 Z=0.25000000
      -7: X=0.10680000 Y=0.49110000 Z=0.75000000
Br         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  35.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.46540000 Y=0.29680000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -8: X=0.53460000 Y=0.70320000 Z=0.75000000
      -8: X=0.53460000 Y=0.79680000 Z=0.25000000
      -8: X=0.46540000 Y=0.20320000 Z=0.75000000
Br         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  35.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000