P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 21.920823 16.818563 15.684727 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.22000000 Y=0.25000000 Z=0.10000000
          MULT= 4          ISPLIT= 8
      -1: X=0.78000000 Y=0.75000000 Z=0.90000000
      -1: X=0.72000000 Y=0.25000000 Z=0.40000000
      -1: X=0.28000000 Y=0.75000000 Z=0.60000000
Hg         NPT=  781  R0=.000005000 RMT= 2.50000     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  -2: X=0.00000000 Y=0.00000000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -2: X=0.50000000 Y=0.00000000 Z=0.00000000
      -2: X=0.50000000 Y=0.50000000 Z=0.00000000
      -2: X=0.00000000 Y=0.50000000 Z=0.50000000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
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=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.50000000 Y=0.00000000 Z=0.50000000
      -3: X=0.50000000 Y=0.50000000 Z=0.50000000
      -3: X=0.00000000 Y=0.50000000 Z=0.00000000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.06000000 Y=0.25000000 Z=0.75000000
          MULT= 4          ISPLIT= 8
      -4: X=0.94000000 Y=0.75000000 Z=0.25000000
      -4: X=0.56000000 Y=0.25000000 Z=0.75000000
      -4: X=0.44000000 Y=0.75000000 Z=0.25000000
Cl         NPT=  781  R0=.000100000 RMT= 2.18        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=0.44000000 Y=0.25000000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -5: X=0.56000000 Y=0.75000000 Z=0.75000000
      -5: X=0.94000000 Y=0.25000000 Z=0.25000000
      -5: X=0.06000000 Y=0.75000000 Z=0.75000000
Cl         NPT=  781  R0=.000100000 RMT= 2.18        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=0.19000000 Y=0.00000000 Z=0.25000000
          MULT= 8          ISPLIT= 8
      -6: X=0.81000000 Y=0.00000000 Z=0.75000000
      -6: X=0.69000000 Y=0.00000000 Z=0.25000000
      -6: X=0.31000000 Y=0.00000000 Z=0.75000000
      -6: X=0.31000000 Y=0.50000000 Z=0.75000000
      -6: X=0.69000000 Y=0.50000000 Z=0.25000000
      -6: X=0.81000000 Y=0.50000000 Z=0.75000000
      -6: X=0.19000000 Y=0.50000000 Z=0.25000000
Cl         NPT=  781  R0=.000100000 RMT= 2.18        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000