B   LATTICE,NONEQUIV.ATOMS   5   72 Ibam                                       
MODE OF CALC=RELA unit=bohr                                                    
 11.536778 21.956728 22.128693 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.21450000 Y=0.14050000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.78550000 Y=0.85950000 Z=0.00000000
      -1: X=0.78550000 Y=0.14050000 Z=0.50000000
      -1: X=0.21450000 Y=0.85950000 Z=0.50000000
Hg         NPT=  781  R0=.000005000 RMT= 2.11        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=0.00000000 Y=0.33820000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.66180000 Z=0.75000000
      -2: X=0.00000000 Y=0.33820000 Z=0.75000000
      -2: X=0.00000000 Y=0.66180000 Z=0.25000000
Hg         NPT=  781  R0=.000005000 RMT= 2.11        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  -3: X=0.00000000 Y=0.00000000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.00000000 Z=0.75000000
Hg         NPT=  781  R0=.000005000 RMT= 2.11        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  -4: X=0.22500000 Y=0.39180000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.77500000 Y=0.60820000 Z=0.00000000
      -4: X=0.77500000 Y=0.39180000 Z=0.50000000
      -4: X=0.22500000 Y=0.60820000 Z=0.50000000
Cl         NPT=  781  R0=.000100000 RMT= 2.46        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.19900000 Y=0.14400000 Z=0.17540000
          MULT= 8          ISPLIT= 8
      -5: X=0.80100000 Y=0.85600000 Z=0.82460000
      -5: X=0.19900000 Y=0.14400000 Z=0.82460000
      -5: X=0.80100000 Y=0.85600000 Z=0.17540000
      -5: X=0.80100000 Y=0.14400000 Z=0.67540000
      -5: X=0.19900000 Y=0.85600000 Z=0.32460000
      -5: X=0.80100000 Y=0.14400000 Z=0.32460000
      -5: X=0.19900000 Y=0.85600000 Z=0.67540000
O          NPT=  781  R0=.000100000 RMT= 1.73        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000