P   LATTICE,NONEQUIV.ATOMS   3  124 P4/mcc                                     
MODE OF CALC=RELA unit=bohr                                                    
 10.877264 10.877264 19.696615 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.25000000
          MULT= 2          ISPLIT=-2
      -1: X=0.00000000 Y=0.00000000 Z=0.75000000
Hg         NPT=  781  R0=.000005000 RMT= 2.38        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=0.50000000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.50000000 Y=0.00000000 Z=0.00000000
      -2: X=0.00000000 Y=0.50000000 Z=0.50000000
      -2: X=0.50000000 Y=0.00000000 Z=0.50000000
Au         NPT=  781  R0=.000005000 RMT= 1.94        Z:  79.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.14800000 Y=0.31200000 Z=0.12790000
          MULT=16          ISPLIT= 8
      -3: X=0.85200000 Y=0.68800000 Z=0.87210000
      -3: X=0.68800000 Y=0.14800000 Z=0.12790000
      -3: X=0.31200000 Y=0.85200000 Z=0.87210000
      -3: X=0.85200000 Y=0.31200000 Z=0.62790000
      -3: X=0.14800000 Y=0.68800000 Z=0.37210000
      -3: X=0.85200000 Y=0.68800000 Z=0.12790000
      -3: X=0.14800000 Y=0.31200000 Z=0.87210000
      -3: X=0.68800000 Y=0.85200000 Z=0.62790000
      -3: X=0.31200000 Y=0.14800000 Z=0.37210000
      -3: X=0.31200000 Y=0.85200000 Z=0.12790000
      -3: X=0.68800000 Y=0.14800000 Z=0.87210000
      -3: X=0.14800000 Y=0.68800000 Z=0.62790000
      -3: X=0.85200000 Y=0.31200000 Z=0.37210000
      -3: X=0.31200000 Y=0.14800000 Z=0.62790000
      -3: X=0.68800000 Y=0.85200000 Z=0.37210000
F          NPT=  781  R0=.000100000 RMT= 1.67        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000