P   LATTICE,NONEQUIV.ATOMS   6   55 Pbam                                       
MODE OF CALC=RELA unit=bohr                                                    
 23.475690 23.867241  9.639493 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.02729000 Y=0.17389000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.97271000 Y=0.82611000 Z=0.00000000
      -1: X=0.47271000 Y=0.67389000 Z=0.00000000
      -1: X=0.52729000 Y=0.32611000 Z=0.00000000
Ba         NPT=  781  R0=.000010000 RMT= 2.37        Z:  56.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.31945000 Y=0.01517000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.68055000 Y=0.98483000 Z=0.00000000
      -2: X=0.18055000 Y=0.51517000 Z=0.00000000
      -2: X=0.81945000 Y=0.48483000 Z=0.00000000
Ba         NPT=  781  R0=.000010000 RMT= 2.37        Z:  56.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.25595000 Y=0.24118000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -3: X=0.74405000 Y=0.75882000 Z=0.50000000
      -3: X=0.24405000 Y=0.74118000 Z=0.50000000
      -3: X=0.75595000 Y=0.25882000 Z=0.50000000
Ba         NPT=  781  R0=.000010000 RMT= 2.37        Z:  56.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.38734000 Y=0.48172000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -4: X=0.61266000 Y=0.51828000 Z=0.50000000
      -4: X=0.11266000 Y=0.98172000 Z=0.50000000
      -4: X=0.88734000 Y=0.01828000 Z=0.50000000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.01112000 Y=0.38743000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -5: X=0.98888000 Y=0.61257000 Z=0.50000000
      -5: X=0.48888000 Y=0.88743000 Z=0.50000000
      -5: X=0.51112000 Y=0.11257000 Z=0.50000000
Sb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  51.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.22930000 Y=0.19770000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -6: X=0.77070000 Y=0.80230000 Z=0.00000000
      -6: X=0.27070000 Y=0.69770000 Z=0.00000000
      -6: X=0.72930000 Y=0.30230000 Z=0.00000000
O          NPT=  781  R0=.000100000 RMT= 2.37        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000