P   LATTICE,NONEQUIV.ATOMS   5   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
  9.865315 10.420139 25.393762 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.45790000 Y=0.25000000 Z=0.86669000
          MULT= 4          ISPLIT= 8
      -1: X=0.54210000 Y=0.75000000 Z=0.13331000
      -1: X=0.95790000 Y=0.25000000 Z=0.63331000
      -1: X=0.04210000 Y=0.75000000 Z=0.36669000
Tl         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  81.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.07860000 Y=0.25000000 Z=0.12747000
          MULT= 4          ISPLIT= 8
      -2: X=0.92140000 Y=0.75000000 Z=0.87253000
      -2: X=0.57860000 Y=0.25000000 Z=0.37253000
      -2: X=0.42140000 Y=0.75000000 Z=0.62747000
S          NPT=  781  R0=.000100000 RMT= 1.32        Z:  16.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.39370000 Y=0.25000000 Z=0.46650000
          MULT= 4          ISPLIT= 8
      -3: X=0.60630000 Y=0.75000000 Z=0.53350000
      -3: X=0.89370000 Y=0.25000000 Z=0.03350000
      -3: X=0.10630000 Y=0.75000000 Z=0.96650000
F          NPT=  781  R0=.000100000 RMT= 1.57        Z:   9.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.32980000 Y=0.25000000 Z=0.08280000
          MULT= 4          ISPLIT= 8
      -4: X=0.67020000 Y=0.75000000 Z=0.91720000
      -4: X=0.82980000 Y=0.25000000 Z=0.41720000
      -4: X=0.17020000 Y=0.75000000 Z=0.58280000
O          NPT=  781  R0=.000100000 RMT= 1.39        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.00990000 Y=0.02840000 Z=0.17770000
          MULT= 8          ISPLIT= 8
      -5: X=0.99010000 Y=0.97160000 Z=0.82230000
      -5: X=0.50990000 Y=0.02840000 Z=0.32230000
      -5: X=0.49010000 Y=0.97160000 Z=0.67770000
      -5: X=0.49010000 Y=0.52840000 Z=0.67770000
      -5: X=0.50990000 Y=0.47160000 Z=0.32230000
      -5: X=0.99010000 Y=0.52840000 Z=0.82230000
      -5: X=0.00990000 Y=0.47160000 Z=0.17770000
O          NPT=  781  R0=.000100000 RMT= 1.39        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000