P   LATTICE,NONEQUIV.ATOMS   5  218 P-43n                                      
MODE OF CALC=RELA unit=bohr                                                    
 15.399945 15.399945 15.399945 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.16740000 Y=0.16740000 Z=0.16740000
          MULT= 8          ISPLIT= 4
      -1: X=0.66740000 Y=0.33260000 Z=0.33260000
      -1: X=0.16740000 Y=0.83260000 Z=0.83260000
      -1: X=0.83260000 Y=0.83260000 Z=0.16740000
      -1: X=0.33260000 Y=0.33260000 Z=0.66740000
      -1: X=0.33260000 Y=0.66740000 Z=0.33260000
      -1: X=0.83260000 Y=0.16740000 Z=0.83260000
      -1: X=0.66740000 Y=0.66740000 Z=0.66740000
Zn         NPT=  781  R0=.000050000 RMT= 1.97        Z:  30.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -2: X=0.13820000 Y=0.13850000 Z=0.40290000
          MULT=24          ISPLIT= 8
      -2: X=0.63850000 Y=0.36180000 Z=0.09710000
      -2: X=0.13820000 Y=0.86150000 Z=0.59710000
      -2: X=0.40290000 Y=0.13820000 Z=0.13850000
      -2: X=0.86180000 Y=0.86150000 Z=0.40290000
      -2: X=0.36150000 Y=0.36180000 Z=0.90290000
      -2: X=0.63820000 Y=0.09710000 Z=0.36150000
      -2: X=0.36150000 Y=0.63820000 Z=0.09710000
      -2: X=0.86180000 Y=0.13850000 Z=0.59710000
      -2: X=0.59710000 Y=0.86180000 Z=0.13850000
      -2: X=0.63850000 Y=0.63820000 Z=0.90290000
      -2: X=0.36180000 Y=0.90290000 Z=0.36150000
      -2: X=0.40290000 Y=0.86180000 Z=0.86150000
      -2: X=0.36180000 Y=0.09710000 Z=0.63850000
      -2: X=0.59710000 Y=0.13820000 Z=0.86150000
      -2: X=0.63820000 Y=0.90290000 Z=0.63850000
      -2: X=0.09710000 Y=0.63850000 Z=0.36180000
      -2: X=0.13850000 Y=0.40290000 Z=0.13820000
      -2: X=0.90290000 Y=0.36150000 Z=0.36180000
      -2: X=0.86150000 Y=0.59710000 Z=0.13820000
      -2: X=0.09710000 Y=0.36150000 Z=0.63820000
      -2: X=0.86150000 Y=0.40290000 Z=0.86180000
      -2: X=0.90290000 Y=0.63850000 Z=0.63820000
      -2: X=0.13850000 Y=0.59710000 Z=0.86180000
O          NPT=  781  R0=.000100000 RMT= 1.67        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.25000000 Y=0.00000000 Z=0.50000000
          MULT= 6          ISPLIT=-2
      -3: X=0.50000000 Y=0.25000000 Z=0.00000000
      -3: X=0.75000000 Y=0.00000000 Z=0.50000000
      -3: X=0.50000000 Y=0.75000000 Z=0.00000000
      -3: X=0.00000000 Y=0.50000000 Z=0.25000000
      -3: X=0.00000000 Y=0.50000000 Z=0.75000000
Be         NPT=  781  R0=.000100000 RMT= 1.44        Z:   4.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.25000000 Y=0.50000000 Z=0.00000000
          MULT= 6          ISPLIT=-2
      -4: X=0.00000000 Y=0.25000000 Z=0.50000000
      -4: X=0.75000000 Y=0.50000000 Z=0.00000000
      -4: X=0.00000000 Y=0.75000000 Z=0.50000000
      -4: X=0.50000000 Y=0.00000000 Z=0.25000000
      -4: X=0.50000000 Y=0.00000000 Z=0.75000000
Si         NPT=  781  R0=.000100000 RMT= 1.43        Z:  14.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM   5: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 2
       5: X=0.50000000 Y=0.50000000 Z=0.50000000
S          NPT=  781  R0=.000100000 RMT= 2.00        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000