H   LATTICE,NONEQUIV.ATOMS   4  181 P6422                                      
MODE OF CALC=RELA unit=bohr                                                    
  9.972085  9.972085 20.921158 90.000000 90.000000120.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 3          ISPLIT= 8
      -1: X=0.00000000 Y=0.00000000 Z=0.66666667
      -1: X=0.00000000 Y=0.00000000 Z=0.33333334
Li         NPT=  781  R0=.000100000 RMT= 1.73        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  -2: X=0.50000000 Y=0.00000000 Z=0.50000000
          MULT= 3          ISPLIT= 8
      -2: X=0.50000000 Y=0.50000000 Z=0.16666667
      -2: X=0.00000000 Y=0.50000000 Z=0.83333334
Al         NPT=  781  R0=.000100000 RMT= 1.56        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=0.50000000 Y=0.00000000 Z=0.00000000
          MULT= 3          ISPLIT= 8
      -3: X=0.50000000 Y=0.50000000 Z=0.66666667
      -3: X=0.00000000 Y=0.50000000 Z=0.33333334
Si         NPT=  781  R0=.000100000 RMT= 1.46        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  -4: X=0.21110000 Y=0.40450000 Z=0.25420000
          MULT=12          ISPLIT= 8
      -4: X=0.80660000 Y=0.21110000 Z=0.92086667
      -4: X=0.59550000 Y=0.78890000 Z=0.07913334
      -4: X=0.59550000 Y=0.80660000 Z=0.58753333
      -4: X=0.80660000 Y=0.59550000 Z=0.74580000
      -4: X=0.78890000 Y=0.59550000 Z=0.25420000
      -4: X=0.21110000 Y=0.80660000 Z=0.41246667
      -4: X=0.19340000 Y=0.78890000 Z=0.92086667
      -4: X=0.40450000 Y=0.21110000 Z=0.07913333
      -4: X=0.40450000 Y=0.19340000 Z=0.58753333
      -4: X=0.19340000 Y=0.40450000 Z=0.74580000
      -4: X=0.78890000 Y=0.19340000 Z=0.41246667
O          NPT=  781  R0=.000100000 RMT= 1.56        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000