P   LATTICE,NONEQUIV.ATOMS   2  198 P213                                       
MODE OF CALC=RELA unit=bohr                                                    
  8.821242  8.821242  8.821242 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.40000000 Y=0.40000000 Z=0.40000000
          MULT= 4          ISPLIT= 4
      -1: X=0.10000000 Y=0.60000000 Z=0.90000000
      -1: X=0.90000000 Y=0.10000000 Z=0.60000000
      -1: X=0.60000000 Y=0.90000000 Z=0.10000000
Au         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  79.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -2: X=0.09400000 Y=0.09400000 Z=0.09400000
          MULT= 4          ISPLIT= 4
      -2: X=0.40600000 Y=0.90600000 Z=0.59400000
      -2: X=0.59400000 Y=0.40600000 Z=0.90600000
      -2: X=0.90600000 Y=0.59400000 Z=0.40600000
Be         NPT=  781  R0=.000100000 RMT= 1.92        Z:   4.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503