H   LATTICE,NONEQUIV.ATOMS   5  169 P61                                        
MODE OF CALC=RELA unit=bohr                                                    
 12.166057 12.166057 33.822318 90.000000 90.000000120.000000                   
ATOM  -1: X=0.35710000 Y=0.01220000 Z=0.04948000
          MULT= 6          ISPLIT= 8
      -1: X=0.34490000 Y=0.35710000 Z=0.21614667
      -1: X=0.98780000 Y=0.34490000 Z=0.38281333
      -1: X=0.64290000 Y=0.98780000 Z=0.54948000
      -1: X=0.65510000 Y=0.64290000 Z=0.71614667
      -1: X=0.01220000 Y=0.65510000 Z=0.88281333
Al         NPT=  781  R0=.000100000 RMT= 2.09        Z:  13.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.33340000 Y=0.01050000 Z=0.71160000
          MULT= 6          ISPLIT= 8
      -2: X=0.32290000 Y=0.33340000 Z=0.87826667
      -2: X=0.98950000 Y=0.32290000 Z=0.04493333
      -2: X=0.66660000 Y=0.98950000 Z=0.21160000
      -2: X=0.67710000 Y=0.66660000 Z=0.37826667
      -2: X=0.01050000 Y=0.67710000 Z=0.54493333
Al         NPT=  781  R0=.000100000 RMT= 2.09        Z:  13.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.33500000 Y=0.01180000 Z=0.17726000
          MULT= 6          ISPLIT= 8
      -3: X=0.32320000 Y=0.33500000 Z=0.34392667
      -3: X=0.98820000 Y=0.32320000 Z=0.51059333
      -3: X=0.66500000 Y=0.98820000 Z=0.67726000
      -3: X=0.67680000 Y=0.66500000 Z=0.84392667
      -3: X=0.01180000 Y=0.67680000 Z=0.01059333
S          NPT=  781  R0=.000100000 RMT= 1.99        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00020000 Y=0.33530000 Z=0.17363000
          MULT= 6          ISPLIT= 8
      -4: X=0.66490000 Y=0.00020000 Z=0.34029667
      -4: X=0.66470000 Y=0.66490000 Z=0.50696333
      -4: X=0.99980000 Y=0.66470000 Z=0.67363000
      -4: X=0.33510000 Y=0.99980000 Z=0.84029667
      -4: X=0.33530000 Y=0.33510000 Z=0.00696333
S          NPT=  781  R0=.000100000 RMT= 1.99        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.66820000 Y=0.00570000 Z=0.00579000
          MULT= 6          ISPLIT= 8
      -5: X=0.66250000 Y=0.66820000 Z=0.17245667
      -5: X=0.99430000 Y=0.66250000 Z=0.33912333
      -5: X=0.33180000 Y=0.99430000 Z=0.50579000
      -5: X=0.33750000 Y=0.33180000 Z=0.67245667
      -5: X=0.00570000 Y=0.33750000 Z=0.83912333
S          NPT=  781  R0=.000100000 RMT= 1.99        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000