P   LATTICE,NONEQUIV.ATOMS   3   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 11.007655 13.273436  9.167061 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.36940000 Y=0.25000000 Z=0.46010000
          MULT= 4          ISPLIT= 8
      -1: X=0.63060000 Y=0.75000000 Z=0.53990000
      -1: X=0.86940000 Y=0.25000000 Z=0.03990000
      -1: X=0.13060000 Y=0.75000000 Z=0.96010000
Tl         NPT=  781  R0=.000005000 RMT= 2.11        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=0.03800000 Y=0.25000000 Z=0.62400000
          MULT= 4          ISPLIT= 8
      -2: X=0.96200000 Y=0.75000000 Z=0.37600000
      -2: X=0.53800000 Y=0.25000000 Z=0.87600000
      -2: X=0.46200000 Y=0.75000000 Z=0.12400000
F          NPT=  781  R0=.000100000 RMT= 1.81        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  -3: X=0.16900000 Y=0.07400000 Z=0.16300000
          MULT= 8          ISPLIT= 8
      -3: X=0.83100000 Y=0.92600000 Z=0.83700000
      -3: X=0.66900000 Y=0.07400000 Z=0.33700000
      -3: X=0.33100000 Y=0.92600000 Z=0.66300000
      -3: X=0.33100000 Y=0.57400000 Z=0.66300000
      -3: X=0.66900000 Y=0.42600000 Z=0.33700000
      -3: X=0.83100000 Y=0.57400000 Z=0.83700000
      -3: X=0.16900000 Y=0.42600000 Z=0.16300000
F          NPT=  781  R0=.000100000 RMT= 1.81        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000