P   LATTICE,NONEQUIV.ATOMS   5   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 17.831456  7.940629 29.492956 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.43050000 Y=0.25000000 Z=0.67400000
          MULT= 4          ISPLIT= 8
      -1: X=0.56950000 Y=0.75000000 Z=0.32600000
      -1: X=0.93050000 Y=0.25000000 Z=0.82600000
      -1: X=0.06950000 Y=0.75000000 Z=0.17400000
Rb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  37.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.16510000 Y=0.25000000 Z=0.44360000
          MULT= 4          ISPLIT= 8
      -2: X=0.83490000 Y=0.75000000 Z=0.55640000
      -2: X=0.66510000 Y=0.25000000 Z=0.05640000
      -2: X=0.33490000 Y=0.75000000 Z=0.94360000
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=0.28260000 Y=0.25000000 Z=0.29110000
          MULT= 4          ISPLIT= 8
      -3: X=0.71740000 Y=0.75000000 Z=0.70890000
      -3: X=0.78260000 Y=0.25000000 Z=0.20890000
      -3: X=0.21740000 Y=0.75000000 Z=0.79110000
Br         NPT=  781  R0=.000050000 RMT= 2.40        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=0.16930000 Y=0.25000000 Z=0.00500000
          MULT= 4          ISPLIT= 8
      -4: X=0.83070000 Y=0.75000000 Z=0.99500000
      -4: X=0.66930000 Y=0.25000000 Z=0.49500000
      -4: X=0.33070000 Y=0.75000000 Z=0.50500000
Br         NPT=  781  R0=.000050000 RMT= 2.40        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=0.02760000 Y=0.25000000 Z=0.60130000
          MULT= 4          ISPLIT= 8
      -5: X=0.97240000 Y=0.75000000 Z=0.39870000
      -5: X=0.52760000 Y=0.25000000 Z=0.89870000
      -5: X=0.47240000 Y=0.75000000 Z=0.10130000
Br         NPT=  781  R0=.000050000 RMT= 2.40        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000