P   LATTICE,NONEQUIV.ATOMS   7   55 Pbam                                       
MODE OF CALC=RELA unit=bohr                                                    
 25.242962 28.926038  9.044229 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.32730000 Y=0.01720000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -1: X=0.67270000 Y=0.98280000 Z=0.00000000
      -1: X=0.17270000 Y=0.51720000 Z=0.00000000
      -1: X=0.82730000 Y=0.48280000 Z=0.00000000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     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=0.08710000 Y=0.25230000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -2: X=0.91290000 Y=0.74770000 Z=0.00000000
      -2: X=0.41290000 Y=0.75230000 Z=0.00000000
      -2: X=0.58710000 Y=0.24770000 Z=0.00000000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     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=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -3: X=0.50000000 Y=0.50000000 Z=0.00000000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     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=0.32590000 Y=0.21120000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -4: X=0.67410000 Y=0.78880000 Z=0.50000000
      -4: X=0.17410000 Y=0.71120000 Z=0.50000000
      -4: X=0.82590000 Y=0.28880000 Z=0.50000000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.15710000 Y=0.09700000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -5: X=0.84290000 Y=0.90300000 Z=0.50000000
      -5: X=0.34290000 Y=0.59700000 Z=0.50000000
      -5: X=0.65710000 Y=0.40300000 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=0.33740000 Y=0.31680000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -6: X=0.66260000 Y=0.68320000 Z=0.00000000
      -6: X=0.16260000 Y=0.81680000 Z=0.00000000
      -6: X=0.83740000 Y=0.18320000 Z=0.00000000
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  -7: X=0.01390000 Y=0.40750000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -7: X=0.98610000 Y=0.59250000 Z=0.50000000
      -7: X=0.48610000 Y=0.90750000 Z=0.50000000
      -7: X=0.51390000 Y=0.09250000 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