B   LATTICE,NONEQUIV.ATOMS   6   72 Ibam                                       
MODE OF CALC=RELA unit=bohr                                                    
 13.685397 19.770315 13.229973 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.50000000 Y=0.00000000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -1: X=0.50000000 Y=0.00000000 Z=0.75000000
Ta         NPT=  781  R0=.000005000 RMT= 1.95        Z:  73.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.26150000 Y=0.23580000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.73850000 Y=0.76420000 Z=0.00000000
      -2: X=0.73850000 Y=0.23580000 Z=0.50000000
      -2: X=0.26150000 Y=0.76420000 Z=0.50000000
Ta         NPT=  781  R0=.000005000 RMT= 1.95        Z:  73.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00000000 Y=0.00000000 Z=0.25000000
          MULT= 2          ISPLIT= 8
      -3: X=0.00000000 Y=0.00000000 Z=0.75000000
Na         NPT=  781  R0=.000100000 RMT= 2.37        Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00980000 Y=0.17420000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -4: X=0.99020000 Y=0.82580000 Z=0.00000000
      -4: X=0.99020000 Y=0.17420000 Z=0.50000000
      -4: X=0.00980000 Y=0.82580000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 1.68        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=0.38170000 Y=0.06780000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.61830000 Y=0.93220000 Z=0.00000000
      -5: X=0.61830000 Y=0.06780000 Z=0.50000000
      -5: X=0.38170000 Y=0.93220000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 1.68        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  -6: X=0.30740000 Y=0.14300000 Z=0.29710000
          MULT= 8          ISPLIT= 8
      -6: X=0.69260000 Y=0.85700000 Z=0.70290000
      -6: X=0.30740000 Y=0.14300000 Z=0.70290000
      -6: X=0.69260000 Y=0.85700000 Z=0.29710000
      -6: X=0.69260000 Y=0.14300000 Z=0.79710000
      -6: X=0.30740000 Y=0.85700000 Z=0.20290000
      -6: X=0.69260000 Y=0.14300000 Z=0.20290000
      -6: X=0.30740000 Y=0.85700000 Z=0.79710000
O          NPT=  781  R0=.000100000 RMT= 1.68        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000