P   LATTICE,NONEQUIV.ATOMS   3  198 P213                                       
MODE OF CALC=RELA unit=bohr                                                    
 13.082007 13.082007 13.082007 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.05970000 Y=0.05970000 Z=0.05970000
          MULT= 4          ISPLIT= 4
      -1: X=0.44030000 Y=0.94030000 Z=0.55970000
      -1: X=0.55970000 Y=0.44030000 Z=0.94030000
      -1: X=0.94030000 Y=0.55970000 Z=0.44030000
Al         NPT=  781  R0=.000100000 RMT= 2.19        Z:  13.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -2: X=0.68270000 Y=0.68270000 Z=0.68270000
          MULT= 4          ISPLIT= 4
      -2: X=0.81730000 Y=0.31730000 Z=0.18270000
      -2: X=0.18270000 Y=0.81730000 Z=0.31730000
      -2: X=0.31730000 Y=0.18270000 Z=0.81730000
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  -3: X=0.11720000 Y=0.21250000 Z=0.45070000
          MULT=12          ISPLIT= 8
      -3: X=0.38280000 Y=0.78750000 Z=0.95070000
      -3: X=0.61720000 Y=0.28750000 Z=0.54930000
      -3: X=0.45070000 Y=0.11720000 Z=0.21250000
      -3: X=0.88280000 Y=0.71250000 Z=0.04930000
      -3: X=0.04930000 Y=0.88280000 Z=0.71250000
      -3: X=0.95070000 Y=0.38280000 Z=0.78750000
      -3: X=0.54930000 Y=0.61720000 Z=0.28750000
      -3: X=0.21250000 Y=0.45070000 Z=0.11720000
      -3: X=0.28750000 Y=0.54930000 Z=0.61720000
      -3: X=0.71250000 Y=0.04930000 Z=0.88280000
      -3: X=0.78750000 Y=0.95070000 Z=0.38280000
Au         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  79.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000