P   LATTICE,NONEQUIV.ATOMS   2   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 12.494869 10.431288  6.653726 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.11200000 Y=0.25000000 Z=0.24300000
          MULT= 4          ISPLIT= 8
      -1: X=0.88800000 Y=0.75000000 Z=0.75700000
      -1: X=0.61200000 Y=0.25000000 Z=0.25700000
      -1: X=0.38800000 Y=0.75000000 Z=0.74300000
Hg         NPT=  781  R0=.000005000 RMT= 2.10        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=0.35800000 Y=0.25000000 Z=0.58700000
          MULT= 4          ISPLIT= 8
      -2: X=0.64200000 Y=0.75000000 Z=0.41300000
      -2: X=0.85800000 Y=0.25000000 Z=0.91300000
      -2: X=0.14200000 Y=0.75000000 Z=0.08700000
O          NPT=  781  R0=.000100000 RMT= 1.71        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000