B   LATTICE,NONEQUIV.ATOMS   4  206 Ia-3                                       
MODE OF CALC=RELA unit=bohr                                                    
 20.720847 20.720847 20.720847 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 4
      -1: X=0.00000000 Y=0.50000000 Z=0.00000000
      -1: X=0.00000000 Y=0.00000000 Z=0.50000000
      -1: X=0.00000000 Y=0.50000000 Z=0.50000000
Ti         NPT=  781  R0=.000050000 RMT= 1.93        Z:  22.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -2: X=0.20907000 Y=0.00000000 Z=0.25000000
          MULT=12          ISPLIT= 8
      -2: X=0.79093000 Y=0.00000000 Z=0.75000000
      -2: X=0.79093000 Y=0.50000000 Z=0.25000000
      -2: X=0.20907000 Y=0.50000000 Z=0.75000000
      -2: X=0.25000000 Y=0.20907000 Z=0.00000000
      -2: X=0.75000000 Y=0.79093000 Z=0.00000000
      -2: X=0.75000000 Y=0.29093000 Z=0.00000000
      -2: X=0.25000000 Y=0.70907000 Z=0.00000000
      -2: X=0.00000000 Y=0.25000000 Z=0.20907000
      -2: X=0.00000000 Y=0.75000000 Z=0.79093000
      -2: X=0.00000000 Y=0.75000000 Z=0.29093000
      -2: X=0.00000000 Y=0.25000000 Z=0.70907000
Te         NPT=  781  R0=.000010000 RMT= 1.89        Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.06140000 Y=0.36670000 Z=0.10130000
          MULT=24          ISPLIT= 8
      -3: X=0.93860000 Y=0.63330000 Z=0.89870000
      -3: X=0.93860000 Y=0.13330000 Z=0.10130000
      -3: X=0.06140000 Y=0.86670000 Z=0.89870000
      -3: X=0.06140000 Y=0.63330000 Z=0.39870000
      -3: X=0.93860000 Y=0.36670000 Z=0.60130000
      -3: X=0.10130000 Y=0.06140000 Z=0.36670000
      -3: X=0.89870000 Y=0.93860000 Z=0.63330000
      -3: X=0.93860000 Y=0.86670000 Z=0.39870000
      -3: X=0.06140000 Y=0.13330000 Z=0.60130000
      -3: X=0.89870000 Y=0.43860000 Z=0.36670000
      -3: X=0.10130000 Y=0.56140000 Z=0.63330000
      -3: X=0.10130000 Y=0.93860000 Z=0.13330000
      -3: X=0.89870000 Y=0.06140000 Z=0.86670000
      -3: X=0.89870000 Y=0.56140000 Z=0.13330000
      -3: X=0.10130000 Y=0.43860000 Z=0.86670000
      -3: X=0.36670000 Y=0.10130000 Z=0.06140000
      -3: X=0.63330000 Y=0.89870000 Z=0.93860000
      -3: X=0.63330000 Y=0.39870000 Z=0.06140000
      -3: X=0.36670000 Y=0.60130000 Z=0.93860000
      -3: X=0.36670000 Y=0.89870000 Z=0.43860000
      -3: X=0.63330000 Y=0.10130000 Z=0.56140000
      -3: X=0.63330000 Y=0.60130000 Z=0.43860000
      -3: X=0.36670000 Y=0.39870000 Z=0.56140000
O          NPT=  781  R0=.000100000 RMT= 1.62        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  -4: X=0.17290000 Y=0.17290000 Z=0.17290000
          MULT= 8          ISPLIT= 4
      -4: X=0.82710000 Y=0.82710000 Z=0.82710000
      -4: X=0.82710000 Y=0.32710000 Z=0.17290000
      -4: X=0.17290000 Y=0.67290000 Z=0.82710000
      -4: X=0.17290000 Y=0.82710000 Z=0.32710000
      -4: X=0.82710000 Y=0.17290000 Z=0.67290000
      -4: X=0.82710000 Y=0.67290000 Z=0.32710000
      -4: X=0.17290000 Y=0.32710000 Z=0.67290000
O          NPT=  781  R0=.000100000 RMT= 1.62        Z:   8.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503