P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 19.228152 14.598134 25.514326 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.13800000 Y=0.25000000 Z=0.39700000
          MULT= 4          ISPLIT= 8
      -1: X=0.86200000 Y=0.75000000 Z=0.60300000
      -1: X=0.63800000 Y=0.25000000 Z=0.10300000
      -1: X=0.36200000 Y=0.75000000 Z=0.89700000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.47600000 Y=0.25000000 Z=0.67200000
          MULT= 4          ISPLIT= 8
      -2: X=0.52400000 Y=0.75000000 Z=0.32800000
      -2: X=0.97600000 Y=0.25000000 Z=0.82800000
      -2: X=0.02400000 Y=0.75000000 Z=0.17200000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.23600000 Y=0.25000000 Z=0.07800000
          MULT= 4          ISPLIT= 8
      -3: X=0.76400000 Y=0.75000000 Z=0.92200000
      -3: X=0.73600000 Y=0.25000000 Z=0.42200000
      -3: X=0.26400000 Y=0.75000000 Z=0.57800000
Zn         NPT=  781  R0=.000050000 RMT= 2.30        Z:  30.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.00300000 Y=0.25000000 Z=0.09900000
          MULT= 4          ISPLIT= 8
      -4: X=0.99700000 Y=0.75000000 Z=0.90100000
      -4: X=0.50300000 Y=0.25000000 Z=0.40100000
      -4: X=0.49700000 Y=0.75000000 Z=0.59900000
Br         NPT=  781  R0=.000050000 RMT= 2.19        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=0.31100000 Y=0.25000000 Z=0.91000000
          MULT= 4          ISPLIT= 8
      -5: X=0.68900000 Y=0.75000000 Z=0.09000000
      -5: X=0.81100000 Y=0.25000000 Z=0.59000000
      -5: X=0.18900000 Y=0.75000000 Z=0.41000000
Br         NPT=  781  R0=.000050000 RMT= 2.19        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  -6: X=0.32700000 Y=0.50200000 Z=0.15400000
          MULT= 8          ISPLIT= 8
      -6: X=0.67300000 Y=0.49800000 Z=0.84600000
      -6: X=0.82700000 Y=0.50200000 Z=0.34600000
      -6: X=0.17300000 Y=0.49800000 Z=0.65400000
      -6: X=0.17300000 Y=0.00200000 Z=0.65400000
      -6: X=0.82700000 Y=0.99800000 Z=0.34600000
      -6: X=0.67300000 Y=0.00200000 Z=0.84600000
      -6: X=0.32700000 Y=0.99800000 Z=0.15400000
Br         NPT=  781  R0=.000050000 RMT= 2.19        Z:  35.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000