H   LATTICE,NONEQUIV.ATOMS   5  176 P63/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 13.107140 13.107140 19.241569 90.000000 90.000000120.000000                   
ATOM  -1: X=0.33333333 Y=0.66666667 Z=0.05840000
          MULT= 4          ISPLIT= 4
      -1: X=0.66666667 Y=0.33333333 Z=0.94160000
      -1: X=0.66666666 Y=0.33333333 Z=0.55840000
      -1: X=0.33333334 Y=0.66666667 Z=0.44160000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 4
      -2: X=0.00000000 Y=0.00000000 Z=0.50000000
Zr         NPT=  781  R0=.000010000 RMT= 2.08        Z:  40.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.38920000 Y=0.13080000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.61080000 Y=0.86920000 Z=0.75000000
      -3: X=0.25840000 Y=0.38920000 Z=0.75000000
      -3: X=0.74160000 Y=0.61080000 Z=0.25000000
      -3: X=0.86920000 Y=0.25840000 Z=0.25000000
      -3: X=0.13080000 Y=0.74160000 Z=0.75000000
Si         NPT=  781  R0=.000100000 RMT= 1.39        Z:  14.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.60200000 Y=0.09000000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -4: X=0.39800000 Y=0.91000000 Z=0.75000000
      -4: X=0.51200000 Y=0.60200000 Z=0.75000000
      -4: X=0.48800000 Y=0.39800000 Z=0.25000000
      -4: X=0.91000000 Y=0.51200000 Z=0.25000000
      -4: X=0.09000000 Y=0.48800000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.61        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  -5: X=0.25850000 Y=0.01560000 Z=0.11770000
          MULT=12          ISPLIT= 8
      -5: X=0.74150000 Y=0.98440000 Z=0.88230000
      -5: X=0.24290000 Y=0.25850000 Z=0.61770000
      -5: X=0.75710000 Y=0.74150000 Z=0.38230000
      -5: X=0.98440000 Y=0.24290000 Z=0.11770000
      -5: X=0.01560000 Y=0.75710000 Z=0.88230000
      -5: X=0.74150000 Y=0.98440000 Z=0.61770000
      -5: X=0.25850000 Y=0.01560000 Z=0.38230000
      -5: X=0.75710000 Y=0.74150000 Z=0.11770000
      -5: X=0.24290000 Y=0.25850000 Z=0.88230000
      -5: X=0.01560000 Y=0.75710000 Z=0.61770000
      -5: X=0.98440000 Y=0.24290000 Z=0.38230000
O          NPT=  781  R0=.000100000 RMT= 1.61        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000