H   LATTICE,NONEQUIV.ATOMS   5  188 P-6c2                                      
MODE OF CALC=RELA unit=bohr                                                    
 13.296113 13.296113 19.131587 90.000000 90.000000120.000000                   
ATOM  -1: X=0.66666667 Y=0.33333333 Z=0.00000000
          MULT= 2          ISPLIT= 4
      -1: X=0.66666666 Y=0.33333333 Z=0.50000000
Tl         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  81.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                    -1.0000000 0.0000000 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
Ta         NPT=  781  R0=.000005000 RMT= 1.99        Z:  73.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                    -1.0000000 0.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.11533000 Y=0.37767000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.26234000 Y=0.88467000 Z=0.25000000
      -3: X=0.62233000 Y=0.88467000 Z=0.75000000
      -3: X=0.62233000 Y=0.73766000 Z=0.25000000
      -3: X=0.26234000 Y=0.37767000 Z=0.75000000
      -3: X=0.11533000 Y=0.73766000 Z=0.75000000
Ge         NPT=  781  R0=.000050000 RMT= 1.70        Z:  32.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.08033000 Y=0.60667000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -4: X=0.52634000 Y=0.91967000 Z=0.25000000
      -4: X=0.39333000 Y=0.91967000 Z=0.75000000
      -4: X=0.39333000 Y=0.47366000 Z=0.25000000
      -4: X=0.52634000 Y=0.60667000 Z=0.75000000
      -4: X=0.08033000 Y=0.47366000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.54        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=0.23533000 Y=0.00867000 Z=0.11000000
          MULT=12          ISPLIT= 8
      -5: X=0.77334000 Y=0.76467000 Z=0.39000000
      -5: X=0.99133000 Y=0.76467000 Z=0.89000000
      -5: X=0.99133000 Y=0.22666000 Z=0.11000000
      -5: X=0.77334000 Y=0.00867000 Z=0.61000000
      -5: X=0.23533000 Y=0.00867000 Z=0.39000000
      -5: X=0.23533000 Y=0.22666000 Z=0.89000000
      -5: X=0.77334000 Y=0.76467000 Z=0.11000000
      -5: X=0.99133000 Y=0.76467000 Z=0.61000000
      -5: X=0.99133000 Y=0.22666000 Z=0.39000000
      -5: X=0.77334000 Y=0.00867000 Z=0.89000000
      -5: X=0.23533000 Y=0.22666000 Z=0.61000000
O          NPT=  781  R0=.000100000 RMT= 1.54        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000