P   LATTICE,NONEQUIV.ATOMS   7   55 Pbam                                       
MODE OF CALC=RELA unit=bohr                                                    
 14.327904 44.092980  8.558570 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.20960000 Y=0.49650000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -1: X=0.79040000 Y=0.50350000 Z=0.50000000
      -1: X=0.29040000 Y=0.99650000 Z=0.50000000
      -1: X=0.70960000 Y=0.00350000 Z=0.50000000
Bi         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.01560000 Y=0.31210000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -2: X=0.98440000 Y=0.68790000 Z=0.50000000
      -2: X=0.48440000 Y=0.81210000 Z=0.50000000
      -2: X=0.51560000 Y=0.18790000 Z=0.50000000
Bi         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.03420000 Y=0.13660000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.96580000 Y=0.86340000 Z=0.00000000
      -3: X=0.46580000 Y=0.63660000 Z=0.00000000
      -3: X=0.53420000 Y=0.36340000 Z=0.00000000
Bi         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -4: X=0.50000000 Y=0.50000000 Z=0.00000000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.27260000 Y=0.25370000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -5: X=0.72740000 Y=0.74630000 Z=0.00000000
      -5: X=0.22740000 Y=0.75370000 Z=0.00000000
      -5: X=0.77260000 Y=0.24630000 Z=0.00000000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.45840000 Y=0.08750000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -6: X=0.54160000 Y=0.91250000 Z=0.00000000
      -6: X=0.04160000 Y=0.58750000 Z=0.00000000
      -6: X=0.95840000 Y=0.41250000 Z=0.00000000
Ca         NPT=  781  R0=.000050000 RMT= 2.50000     Z:  20.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.32170000 Y=0.37910000 Z=0.50000000
          MULT= 4          ISPLIT= 8
      -7: X=0.67830000 Y=0.62090000 Z=0.50000000
      -7: X=0.17830000 Y=0.87910000 Z=0.50000000
      -7: X=0.82170000 Y=0.12090000 Z=0.50000000
Al         NPT=  781  R0=.000100000 RMT= 2.37        Z:  13.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000