P   LATTICE,NONEQUIV.ATOMS   5  198 P213                                       
MODE OF CALC=RELA unit=bohr                                                    
 17.829566 17.829566 17.829566 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.56250000 Y=0.56250000 Z=0.56250000
          MULT= 4          ISPLIT= 4
      -1: X=0.93750000 Y=0.43750000 Z=0.06250000
      -1: X=0.06250000 Y=0.93750000 Z=0.43750000
      -1: X=0.43750000 Y=0.06250000 Z=0.93750000
Tl         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  81.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -2: X=0.06250000 Y=0.06250000 Z=0.06250000
          MULT= 4          ISPLIT= 4
      -2: X=0.43750000 Y=0.93750000 Z=0.56250000
      -2: X=0.56250000 Y=0.43750000 Z=0.93750000
      -2: X=0.93750000 Y=0.56250000 Z=0.43750000
Tl         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  81.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -3: X=0.81000000 Y=0.81000000 Z=0.81000000
          MULT= 4          ISPLIT= 4
      -3: X=0.69000000 Y=0.19000000 Z=0.31000000
      -3: X=0.31000000 Y=0.69000000 Z=0.19000000
      -3: X=0.19000000 Y=0.31000000 Z=0.69000000
Tl         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  81.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -4: X=0.31250000 Y=0.31250000 Z=0.31250000
          MULT= 4          ISPLIT= 4
      -4: X=0.18750000 Y=0.68750000 Z=0.81250000
      -4: X=0.81250000 Y=0.18750000 Z=0.68750000
      -4: X=0.68750000 Y=0.81250000 Z=0.18750000
Sb         NPT=  781  R0=.000010000 RMT= 2.25        Z:  51.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -5: X=0.06700000 Y=0.28400000 Z=0.33200000
          MULT=12          ISPLIT= 8
      -5: X=0.43300000 Y=0.71600000 Z=0.83200000
      -5: X=0.56700000 Y=0.21600000 Z=0.66800000
      -5: X=0.33200000 Y=0.06700000 Z=0.28400000
      -5: X=0.93300000 Y=0.78400000 Z=0.16800000
      -5: X=0.16800000 Y=0.93300000 Z=0.78400000
      -5: X=0.83200000 Y=0.43300000 Z=0.71600000
      -5: X=0.66800000 Y=0.56700000 Z=0.21600000
      -5: X=0.28400000 Y=0.33200000 Z=0.06700000
      -5: X=0.21600000 Y=0.66800000 Z=0.56700000
      -5: X=0.78400000 Y=0.16800000 Z=0.93300000
      -5: X=0.71600000 Y=0.83200000 Z=0.43300000
Se         NPT=  781  R0=.000050000 RMT= 2.14        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000