H   LATTICE,NONEQUIV.ATOMS   4  180 P6222                                      
MODE OF CALC=RELA unit=bohr                                                    
  9.958857  9.958857 21.259419 90.000000 90.000000120.000000                   
ATOM  -1: X=0.50000000 Y=0.00000000 Z=0.50000000
          MULT= 3          ISPLIT= 8
      -1: X=0.50000000 Y=0.50000000 Z=0.83333333
      -1: X=0.00000000 Y=0.50000000 Z=0.16666669
Si         NPT=  781  R0=.000100000 RMT= 1.47        Z:  14.00000              
LOCAL ROT MATRIX:    0.8660254 0.5000000 0.0000000
                    -0.5000000 0.8660254 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.50000000 Y=0.00000000 Z=0.00000000
          MULT= 3          ISPLIT= 8
      -2: X=0.50000000 Y=0.50000000 Z=0.33333333
      -2: X=0.00000000 Y=0.50000000 Z=0.66666669
Al         NPT=  781  R0=.000100000 RMT= 1.59        Z:  13.00000              
LOCAL ROT MATRIX:    0.8660254 0.5000000 0.0000000
                    -0.5000000 0.8660254 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 3          ISPLIT= 8
      -3: X=0.00000000 Y=0.00000000 Z=0.33333333
      -3: X=0.00000000 Y=0.00000000 Z=0.66666669
Li         NPT=  781  R0=.000100000 RMT= 1.70        Z:   3.00000              
LOCAL ROT MATRIX:    0.8660254 0.5000000 0.0000000
                    -0.5000000 0.8660254 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.19500000 Y=0.39000000 Z=0.25000000
          MULT=12          ISPLIT= 8
      -4: X=0.80500000 Y=0.19500000 Z=0.58333333
      -4: X=0.61000000 Y=0.80500000 Z=0.41666669
      -4: X=0.61000000 Y=0.80500000 Z=0.91666667
      -4: X=0.80500000 Y=0.61000000 Z=0.75000000
      -4: X=0.80500000 Y=0.61000000 Z=0.25000000
      -4: X=0.19500000 Y=0.80500000 Z=0.08333333
      -4: X=0.19500000 Y=0.80500000 Z=0.58333333
      -4: X=0.39000000 Y=0.19500000 Z=0.41666667
      -4: X=0.39000000 Y=0.19500000 Z=0.91666667
      -4: X=0.19500000 Y=0.39000000 Z=0.75000000
      -4: X=0.80500000 Y=0.19500000 Z=0.08333333
O          NPT=  781  R0=.000100000 RMT= 1.59        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000