P   LATTICE,NONEQUIV.ATOMS   7   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 15.892597 42.048296 16.060782 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.27050000 Y=0.51058000 Z=0.46510000
          MULT= 8          ISPLIT= 8
      -1: X=0.72950000 Y=0.48942000 Z=0.53490000
      -1: X=0.77050000 Y=0.51058000 Z=0.03490000
      -1: X=0.22950000 Y=0.48942000 Z=0.96510000
      -1: X=0.22950000 Y=0.01058000 Z=0.96510000
      -1: X=0.77050000 Y=0.98942000 Z=0.03490000
      -1: X=0.72950000 Y=0.01058000 Z=0.53490000
      -1: X=0.27050000 Y=0.98942000 Z=0.46510000
Tl         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  81.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.20094000 Y=0.16886000 Z=0.00990000
          MULT= 8          ISPLIT= 8
      -2: X=0.79906000 Y=0.83114000 Z=0.99010000
      -2: X=0.70094000 Y=0.16886000 Z=0.49010000
      -2: X=0.29906000 Y=0.83114000 Z=0.50990000
      -2: X=0.29906000 Y=0.66886000 Z=0.50990000
      -2: X=0.70094000 Y=0.33114000 Z=0.49010000
      -2: X=0.79906000 Y=0.66886000 Z=0.99010000
      -2: X=0.20094000 Y=0.33114000 Z=0.00990000
Tl         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  81.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.19750000 Y=0.16394000 Z=0.50370000
          MULT= 8          ISPLIT= 8
      -3: X=0.80250000 Y=0.83606000 Z=0.49630000
      -3: X=0.69750000 Y=0.16394000 Z=0.99630000
      -3: X=0.30250000 Y=0.83606000 Z=0.00370000
      -3: X=0.30250000 Y=0.66394000 Z=0.00370000
      -3: X=0.69750000 Y=0.33606000 Z=0.99630000
      -3: X=0.80250000 Y=0.66394000 Z=0.49630000
      -3: X=0.19750000 Y=0.33606000 Z=0.50370000
Sn         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  50.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.36950000 Y=0.25000000 Z=0.32810000
          MULT= 4          ISPLIT= 8
      -4: X=0.63050000 Y=0.75000000 Z=0.67190000
      -4: X=0.86950000 Y=0.25000000 Z=0.17190000
      -4: X=0.13050000 Y=0.75000000 Z=0.82810000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.02380000 Y=0.25000000 Z=0.67410000
          MULT= 4          ISPLIT= 8
      -5: X=0.97620000 Y=0.75000000 Z=0.32590000
      -5: X=0.52380000 Y=0.25000000 Z=0.82590000
      -5: X=0.47620000 Y=0.75000000 Z=0.17410000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.09680000 Y=0.60150000 Z=0.19340000
          MULT= 8          ISPLIT= 8
      -6: X=0.90320000 Y=0.39850000 Z=0.80660000
      -6: X=0.59680000 Y=0.60150000 Z=0.30660000
      -6: X=0.40320000 Y=0.39850000 Z=0.69340000
      -6: X=0.40320000 Y=0.10150000 Z=0.69340000
      -6: X=0.59680000 Y=0.89850000 Z=0.30660000
      -6: X=0.90320000 Y=0.10150000 Z=0.80660000
      -6: X=0.09680000 Y=0.89850000 Z=0.19340000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.01790000 Y=0.08922000 Z=0.31540000
          MULT= 8          ISPLIT= 8
      -7: X=0.98210000 Y=0.91078000 Z=0.68460000
      -7: X=0.51790000 Y=0.08922000 Z=0.18460000
      -7: X=0.48210000 Y=0.91078000 Z=0.81540000
      -7: X=0.48210000 Y=0.58922000 Z=0.81540000
      -7: X=0.51790000 Y=0.41078000 Z=0.18460000
      -7: X=0.98210000 Y=0.58922000 Z=0.68460000
      -7: X=0.01790000 Y=0.41078000 Z=0.31540000
Te         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  52.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000