H   LATTICE,NONEQUIV.ATOMS   6  194 P63/mmc 
MODE OF CALC=RELA unit=bohr
 17.068006 17.068006 16.873365 90.000000 90.000000120.000000
ATOM  -1: X=0.33333333 Y=0.66666667 Z=0.61000000
          MULT= 4          ISPLIT=15
      -1: X=0.66666667 Y=0.33333333 Z=0.39000000
      -1: X=0.66666666 Y=0.33333333 Z=0.11000000
      -1: X=0.33333334 Y=0.66666667 Z=0.89000000
Zn         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  30.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.50000000 Y=0.00000000 Z=0.00000000
          MULT= 6          ISPLIT=15
      -2: X=0.50000000 Y=0.50000000 Z=0.50000000
      -2: X=0.00000000 Y=0.50000000 Z=0.50000000
      -2: X=0.00000000 Y=0.50000000 Z=0.00000000
      -2: X=0.50000000 Y=0.00000000 Z=0.50000000
      -2: X=0.50000000 Y=0.50000000 Z=0.00000000
Zn         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  30.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.36300000 Y=0.03000000 Z=0.25000000
          MULT=12          ISPLIT=15
      -3: X=0.63700000 Y=0.97000000 Z=0.75000000
      -3: X=0.33300000 Y=0.36300000 Z=0.75000000
      -3: X=0.66700000 Y=0.63700000 Z=0.25000000
      -3: X=0.03000000 Y=0.36300000 Z=0.75000000
      -3: X=0.97000000 Y=0.63700000 Z=0.25000000
      -3: X=0.97000000 Y=0.33300000 Z=0.25000000
      -3: X=0.03000000 Y=0.66700000 Z=0.75000000
      -3: X=0.66700000 Y=0.03000000 Z=0.25000000
      -3: X=0.33300000 Y=0.97000000 Z=0.75000000
      -3: X=0.63700000 Y=0.66700000 Z=0.75000000
      -3: X=0.36300000 Y=0.33300000 Z=0.25000000
Zn         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  30.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.16700000 Y=0.33400000 Z=0.00000000
          MULT=12          ISPLIT=15
      -4: X=0.83300000 Y=0.66600000 Z=0.00000000
      -4: X=0.83300000 Y=0.16700000 Z=0.50000000
      -4: X=0.16700000 Y=0.83300000 Z=0.50000000
      -4: X=0.33400000 Y=0.16700000 Z=0.50000000
      -4: X=0.66600000 Y=0.83300000 Z=0.50000000
      -4: X=0.66600000 Y=0.83300000 Z=0.00000000
      -4: X=0.33400000 Y=0.16700000 Z=0.00000000
      -4: X=0.83300000 Y=0.66600000 Z=0.50000000
      -4: X=0.16700000 Y=0.33400000 Z=0.50000000
      -4: X=0.16700000 Y=0.83300000 Z=0.00000000
      -4: X=0.83300000 Y=0.16700000 Z=0.00000000
Zn         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  30.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.00000000 Y=0.00000000 Z=0.25000000
          MULT= 2          ISPLIT=15
      -5: X=0.00000000 Y=0.00000000 Z=0.75000000
Th         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  90.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.33333333 Y=0.66666667 Z=0.25000000
          MULT= 2          ISPLIT=15
      -6: X=0.66666667 Y=0.33333333 Z=0.75000000
Th         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  90.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000