P   LATTICE,NONEQUIV.ATOMS   5   62 Pnma                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.916159  8.023777 20.616912 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.24650000 Y=0.25000000 Z=0.32480000
          MULT= 4          ISPLIT= 8
      -1: X=0.75350000 Y=0.75000000 Z=0.67520000
      -1: X=0.74650000 Y=0.25000000 Z=0.17520000
      -1: X=0.25350000 Y=0.75000000 Z=0.82480000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  56.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.04980000 Y=0.25000000 Z=0.61540000
          MULT= 4          ISPLIT= 8
      -2: X=0.95020000 Y=0.75000000 Z=0.38460000
      -2: X=0.54980000 Y=0.25000000 Z=0.88460000
      -2: X=0.45020000 Y=0.75000000 Z=0.11540000
Zn         NPT=  781  R0=.000050000 RMT= 2.41        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  -3: X=0.09640000 Y=0.25000000 Z=0.05000000
          MULT= 4          ISPLIT= 8
      -3: X=0.90360000 Y=0.75000000 Z=0.95000000
      -3: X=0.59640000 Y=0.25000000 Z=0.45000000
      -3: X=0.40360000 Y=0.75000000 Z=0.55000000
Zn         NPT=  781  R0=.000050000 RMT= 2.41        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=0.47920000 Y=0.25000000 Z=0.66180000
          MULT= 4          ISPLIT= 8
      -4: X=0.52080000 Y=0.75000000 Z=0.33820000
      -4: X=0.97920000 Y=0.25000000 Z=0.83820000
      -4: X=0.02080000 Y=0.75000000 Z=0.16180000
As         NPT=  781  R0=.000050000 RMT= 2.29        Z:  33.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.34800000 Y=0.25000000 Z=0.03860000
          MULT= 4          ISPLIT= 8
      -5: X=0.65200000 Y=0.75000000 Z=0.96140000
      -5: X=0.84800000 Y=0.25000000 Z=0.46140000
      -5: X=0.15200000 Y=0.75000000 Z=0.53860000
As         NPT=  781  R0=.000050000 RMT= 2.29        Z:  33.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000