B   LATTICE,NONEQUIV.ATOMS   4   72 Ibam                                       
MODE OF CALC=RELA unit=bohr                                                    
 12.159443 22.681627 27.755164 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.26703000 Y=0.11903000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.73297000 Y=0.88097000 Z=0.00000000
      -1: X=0.73297000 Y=0.11903000 Z=0.50000000
      -1: X=0.26703000 Y=0.88097000 Z=0.50000000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -2: X=0.00000000 Y=0.00000000 Z=0.75000000
Hg         NPT=  781  R0=.000005000 RMT= 2.44        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  -3: X=0.00000000 Y=0.33211000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.66789000 Z=0.75000000
      -3: X=0.00000000 Y=0.33211000 Z=0.75000000
      -3: X=0.00000000 Y=0.66789000 Z=0.25000000
Hg         NPT=  781  R0=.000005000 RMT= 2.44        Z:  80.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.21798000 Y=0.13246000 Z=0.36028000
          MULT= 8          ISPLIT= 8
      -4: X=0.78202000 Y=0.86754000 Z=0.63972000
      -4: X=0.21798000 Y=0.13246000 Z=0.63972000
      -4: X=0.78202000 Y=0.86754000 Z=0.36028000
      -4: X=0.78202000 Y=0.13246000 Z=0.86028000
      -4: X=0.21798000 Y=0.86754000 Z=0.13972000
      -4: X=0.78202000 Y=0.13246000 Z=0.13972000
      -4: X=0.21798000 Y=0.86754000 Z=0.86028000
Se         NPT=  781  R0=.000050000 RMT= 2.20        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000