P   LATTICE,NONEQUIV.ATOMS   6   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 17.398142 13.682562 23.867241 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.37031000 Y=0.25000000 Z=0.09341000
          MULT= 4          ISPLIT= 8
      -1: X=0.62969000 Y=0.75000000 Z=0.90659000
      -1: X=0.87031000 Y=0.25000000 Z=0.40659000
      -1: X=0.12969000 Y=0.75000000 Z=0.59341000
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=0.01327000 Y=0.25000000 Z=0.81921000
          MULT= 4          ISPLIT= 8
      -2: X=0.98673000 Y=0.75000000 Z=0.18079000
      -2: X=0.51327000 Y=0.25000000 Z=0.68079000
      -2: X=0.48673000 Y=0.75000000 Z=0.31921000
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  -3: X=0.27656000 Y=0.25000000 Z=0.42179000
          MULT= 4          ISPLIT= 8
      -3: X=0.72344000 Y=0.75000000 Z=0.57821000
      -3: X=0.77656000 Y=0.25000000 Z=0.07821000
      -3: X=0.22344000 Y=0.75000000 Z=0.92179000
Zn         NPT=  781  R0=.000050000 RMT= 2.25        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=0.01837000 Y=0.25000000 Z=0.08038000
          MULT= 4          ISPLIT= 8
      -4: X=0.98163000 Y=0.75000000 Z=0.91962000
      -4: X=0.51837000 Y=0.25000000 Z=0.41962000
      -4: X=0.48163000 Y=0.75000000 Z=0.58038000
Cl         NPT=  781  R0=.000100000 RMT= 1.93        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.17831000 Y=0.25000000 Z=0.58430000
          MULT= 4          ISPLIT= 8
      -5: X=0.82169000 Y=0.75000000 Z=0.41570000
      -5: X=0.67831000 Y=0.25000000 Z=0.91570000
      -5: X=0.32169000 Y=0.75000000 Z=0.08430000
Cl         NPT=  781  R0=.000100000 RMT= 1.93        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.18755000 Y=0.00171000 Z=0.33945000
          MULT= 8          ISPLIT= 8
      -6: X=0.81245000 Y=0.99829000 Z=0.66055000
      -6: X=0.68755000 Y=0.00171000 Z=0.16055000
      -6: X=0.31245000 Y=0.99829000 Z=0.83945000
      -6: X=0.31245000 Y=0.50171000 Z=0.83945000
      -6: X=0.68755000 Y=0.49829000 Z=0.16055000
      -6: X=0.81245000 Y=0.50171000 Z=0.66055000
      -6: X=0.18755000 Y=0.49829000 Z=0.33945000
Cl         NPT=  781  R0=.000100000 RMT= 1.93        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000