P   LATTICE,NONEQUIV.ATOMS   5   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 17.723741  7.804569 29.137687 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.43320000 Y=0.25000000 Z=0.67600000
          MULT= 4          ISPLIT= 8
      -1: X=0.56680000 Y=0.75000000 Z=0.32400000
      -1: X=0.93320000 Y=0.25000000 Z=0.82400000
      -1: X=0.06680000 Y=0.75000000 Z=0.17600000
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=0.16810000 Y=0.25000000 Z=0.44370000
          MULT= 4          ISPLIT= 8
      -2: X=0.83190000 Y=0.75000000 Z=0.55630000
      -2: X=0.66810000 Y=0.25000000 Z=0.05630000
      -2: X=0.33190000 Y=0.75000000 Z=0.94370000
Cd         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  48.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.28910000 Y=0.25000000 Z=0.28860000
          MULT= 4          ISPLIT= 8
      -3: X=0.71090000 Y=0.75000000 Z=0.71140000
      -3: X=0.78910000 Y=0.25000000 Z=0.21140000
      -3: X=0.21090000 Y=0.75000000 Z=0.78860000
Br         NPT=  781  R0=.000050000 RMT= 2.42        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.16430000 Y=0.25000000 Z=0.00540000
          MULT= 4          ISPLIT= 8
      -4: X=0.83570000 Y=0.75000000 Z=0.99460000
      -4: X=0.66430000 Y=0.25000000 Z=0.49460000
      -4: X=0.33570000 Y=0.75000000 Z=0.50540000
Br         NPT=  781  R0=.000050000 RMT= 2.42        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.02310000 Y=0.25000000 Z=0.60580000
          MULT= 4          ISPLIT= 8
      -5: X=0.97690000 Y=0.75000000 Z=0.39420000
      -5: X=0.52310000 Y=0.25000000 Z=0.89420000
      -5: X=0.47690000 Y=0.75000000 Z=0.10580000
Br         NPT=  781  R0=.000050000 RMT= 2.42        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000